SCHEMBL7430428

SCHEMBL7430428

COc1ccc(CCN(C)CCc2ccc(OC)c(OC)c2)cc1OC

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 2/20 1.00
CYP3A4 P08684 2/20 1.00
CYP2D6 P10635 2/20 1.00
BLM P54132 2/20 0.96
PMP22 Q01453 1/20 0.96
AOC3 Q16853 1/20 0.74
KDM4E B2RXH2 4/20 0.69
SMN1; SMN2 Q16637 1/20 0.69
SMPD1 P17405 7/20 0.68
ALDH1A1 P00352 2/20 0.66
MEN1 O00255 1/20 0.66
KMT2A Q03164 1/20 0.66
CYP2C9 P11712 1/20 0.62
ATM Q13315 1/20 0.61
CA2 P00918 1/20 0.59
ABCB1 P08183 1/20 0.58

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
Hydrochloric Acid SCHEMBL29651387 0.98 BLM (1.00) CYP1A2CYP3A4CYP2D6BLMPMP22
Hydrochloric Acid SCHEMBL7194533 0.98 BLM (1.00) CYP1A2CYP3A4CYP2D6BLMPMP22
SCHEMBL18239557 0.95 CYP3A4 (0.90) CYP1A2CYP3A4CYP2D6BLMPMP22
SCHEMBL7290182 0.93 CYP1A2 (0.87) CYP1A2CYP3A4CYP2D6BLMPMP22
SCHEMBL6575808 0.92 CYP3A4 (0.84) CYP1A2CYP3A4CYP2D6BLMPMP22
SCHEMBL6574463 0.92 CYP3A4 (0.84) CYP1A2CYP3A4CYP2D6BLMPMP22
SCHEMBL27856807 0.92 CYP3A4 (0.84) CYP1A2CYP3A4CYP2D6BLMPMP22
SCHEMBL8828336 0.92 CYP3A4 (0.84) CYP1A2CYP3A4CYP2D6BLMPMP22
SCHEMBL6575575 0.91 CYP1A2 (0.83) CYP1A2CYP3A4CYP2D6BLMPMP22
SCHEMBL2770457 0.90 CYP1A2 (0.81) CYP1A2CYP3A4CYP2D6BLMPMP22

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 21 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230270693-A1 Molecular Targets for Modulation of Dissociative and Associative States THE BOARD OF TRUSTEES OF THE LELAND STANFORD JUNIOR UNIVERSITY 2023-08-31 US claimed
WO-2022035773-A1 MOLECULAR TARGETS FOR MODULATION OF DISSOCIATIVE AND ASSOCIATIVE STATES THE BOARD OF TRUSTEES OF THE LELAND STANFORD JUNIOR UNIVERSITY (US) 2022-02-17 WO claimed
US-4956389-A CARDIOVASCULAR DISORDERS, ANTIISCHEMIC AGENTS WITH N-METHYL-N-BIS(3,4-DIMETHOXYPHENYLETHYL)AMINE YASON S.R.L. (IT) 1990-09-11 US claimed
US-12582616-B2 Molecular targets for modulation of dissociative and associative states THE BOARD OF TRUSTEES OF THE LELAND STANFORD JUNIOR UNIVERSITY (US) 2026-03-24 US disclosed
US-20250241928-A1 CALMODULIN INHIBITORS FOR THE TREATMENT OF RIBOSOMAL DISORDERS AND RIBOSOMOPATHIES CHILDREN'S MEDICAL CENTER CORPORATION (US) 2025-07-31 US disclosed
US-12280064-B2 Calmodulin inhibitors for the treatment of ribosomal disorders and ribosomopathies CHILDREN'S MEDICAL CENTER CORPORATION 2025-04-22 US disclosed
US-20240100018-A1 COMPOUNDS FOR THE TREATMENT OF A DISEASE OR DISORDER, METHODS FOR IDENTIFYING SAID COMPOUNDS CEDARS-SINAI MEDICAL CENTER 2024-03-28 US disclosed
US-20240091238-A1 CALMODULIN INHIBITORS FOR THE TREATMENT OF RIBOSOMAL DISORDERS AND RIBOSOMOPATHIES CHILDREN'S MEDICAL CENTER CORPORATION (US) 2024-03-21 US disclosed
US-20230270693-A1 Molecular Targets for Modulation of Dissociative and Associative States THE BOARD OF TRUSTEES OF THE LELAND STANFORD JUNIOR UNIVERSITY 2023-08-31 US disclosed
US-20230218577-A1 USE OF HEAT SHOCK PROTEIN INHIBITORS FOR THE TREATMENT OF NEURODEVELOPMENTAL DISORDERS THE CHILDREN'S MEDICAL CENTER CORPORATION (US) 2023-07-13 US disclosed
US-11654149-B2 Calmodulin inhibitors for the treatment of ribosomal disorders and ribosomapathies CHILDREN'S MEDICAL CENTER CORPORATION (US) 2023-05-23 US disclosed
US-20220152041-A1 CALMODULIN INHIBITORS FOR THE TREATMENT OF RIBOSOMAL DISORDERS AND RIBOSOMAPATHIES CHILDREN'S MEDICAL CENTER CORPORATION (US) 2022-05-19 US disclosed
WO-2022035773-A1 MOLECULAR TARGETS FOR MODULATION OF DISSOCIATIVE AND ASSOCIATIVE STATES THE BOARD OF TRUSTEES OF THE LELAND STANFORD JUNIOR UNIVERSITY (US) 2022-02-17 WO disclosed
US-9034798-B2 Capture compounds, collections thereof and methods for analyzing the proteome and complex compositions CAPROTEC BIOANALYTICS GMBH (DE) 2015-05-19 US disclosed
US-8569481-B2 Capture compounds, collections thereof and methods for analyzing the proteome and complex compositions PHARMACEUTICALS, INC. (US) 2013-10-29 US disclosed
US-20110118136-A1 Capture compounds, collections thereof and methods for analyzing the proteome and complex compositions KOESTER HUBERT 2011-05-19 US disclosed
US-20100248264-A1 Capture compounds, collections thereof and methods for analyzing the proteome and complex compositions HK PHARMACEUTICALS, INC. 2010-09-30 US disclosed
WO-1998004250-A1 PHARMACEUTICAL COMPOSITIONS FOR THE REVERSION OF MULTIPLE RESISTANCE TO DRUGS CONSULTANTS INTERNATIONAUX SUR LE MEDICAMENT (S.A.R.L.) (FR) 1998-02-05 WO disclosed
WO-1998004250-A1 PHARMACEUTICAL COMPOSITIONS FOR THE REVERSION OF MULTIPLE RESISTANCE TO DRUGS CONSULTANTS INTERNATIONAUX SUR LE MEDICAMENT (S.A.R.L.) (FR) 1998-02-05 WO disclosed
US-4956389-A CARDIOVASCULAR DISORDERS, ANTIISCHEMIC AGENTS WITH N-METHYL-N-BIS(3,4-DIMETHOXYPHENYLETHYL)AMINE YASON S.R.L. (IT) 1990-09-11 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (8 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20110118136-A1 Capture compounds, collections thereof and methods for analyzing the proteome and complex compositions PTMS, QPCTL, SRMS CYP1A2 4732/4885CYP3A4 3746/4885CYP2D6 4323/4885
US-20230218577-A1 USE OF HEAT SHOCK PROTEIN INHIBITORS FOR THE TREATMENT OF NEURODEVELOPMENTAL DISORDERS HSP90AB1, HSP90AA1, HSF1 CYP1A2 4732/4885CYP3A4 4816/4885CYP2D6 4813/4885
US-11654149-B2 Calmodulin inhibitors for the treatment of ribosomal disorders and ribosomapathies CALM1, RACK1, RRBP1 CYP1A2 4636/4885CYP3A4 4828/4885CYP2D6 4722/4885
US-12582616-B2 Molecular targets for modulation of dissociative and associative states FABP7, NCS1, GAP43 CYP1A2 4554/4885CYP3A4 4157/4885CYP2D6 3028/4885
US-20240091238-A1 CALMODULIN INHIBITORS FOR THE TREATMENT OF RIBOSOMAL DISORDERS AND RIBOSOMOPATHIES CALM1, RACK1, CAMK2B CYP1A2 4616/4885CYP3A4 4827/4885CYP2D6 4709/4885
US-20250241928-A1 CALMODULIN INHIBITORS FOR THE TREATMENT OF RIBOSOMAL DISORDERS AND RIBOSOMOPATHIES CALM1, RACK1, CAMK2B CYP1A2 4616/4885CYP3A4 4827/4885CYP2D6 4709/4885
US-20220152041-A1 CALMODULIN INHIBITORS FOR THE TREATMENT OF RIBOSOMAL DISORDERS AND RIBOSOMAPATHIES CALM1, RACK1, RRBP1 CYP1A2 4636/4885CYP3A4 4828/4885CYP2D6 4722/4885
US-12280064-B2 Calmodulin inhibitors for the treatment of ribosomal disorders and ribosomopathies CALM1, RACK1, CAMK2B CYP1A2 4616/4885CYP3A4 4827/4885CYP2D6 4709/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.