SCHEMBL6014422

SCHEMBL6014422

c1ccc(CCCCNCc2ccccc2)cc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 10/20 1.00
MAOA P21397 1/20 0.79
CHRM2 P08172 1/20 0.76
BCHE P06276 2/20 0.70
GAA P10253 1/20 0.69
MAPT P10636 1/20 0.69
MEN1 O00255 1/20 0.67
KMT2A Q03164 1/20 0.67
TDP1 Q9NUW8 1/20 0.67

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
SCHEMBL8097260 0.98 SIGMAR1 (1.00) SIGMAR1MAOACHRM2BCHEGAA
SCHEMBL6014543 0.98 SIGMAR1 (1.00) SIGMAR1MAOACHRM2BCHEGAA
SCHEMBL8092471 0.98 SIGMAR1 (1.00) SIGMAR1MAOACHRM2BCHEGAA
SCHEMBL7756958 0.98 SIGMAR1 (1.00) SIGMAR1MAOACHRM2BCHEGAA
SCHEMBL6014369 0.98 SIGMAR1 (1.00) SIGMAR1MAOACHRM2BCHEGAA
SCHEMBL4065566 0.93 SIGMAR1 (0.88) SIGMAR1MAOACHRM2BCHEGAA
Bromide SCHEMBL11691228 0.91 SIGMAR1 (0.84) SIGMAR1MAOACHRM2BCHEGAA
SCHEMBL11883482 0.91 SIGMAR1 (0.84) SIGMAR1MAOACHRM2BCHEGAA
SCHEMBL4932707 0.91 MAOA (0.95) SIGMAR1MAOACHRM2GAAMAPT
SCHEMBL8851048 0.89 MAOA (1.00) SIGMAR1MAOACHRM2GAAMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1901902-A Thiophene and benzothiophene hydroxamic acid derivatives ATON PHARMA INC (US) 2007-01-24 CN claimed
US-6057371-A TREATMENT OF CENTRAL NERVOUS SYSTEM DISORDERS, GASTROINTESTINAL DISORDERS, DRUG ABUSE, ANGINA, MIGRAINE, HYPERTENSION AND DEPRESSION VIRGINIA COMMONWEALTH UNIVERSITY (US) 2000-05-02 US claimed
EP-0591426-A1 SIGMA RECEPTOR LIGANDS AND THE USE THEREOF VIRGINIA COMMONWEALTH UNIVERSITY (US) 1994-04-13 EP claimed
EP-0507863-A4 SIGMA RECEPTOR LIGANDS AND THE USE THEREOF 1993-07-07 EP claimed
WO-1993000313-A2 SIGMA RECEPTOR LIGANDS AND THE USE THEREOF VIRGINIA COMMONWEALTH UNIVERSITY (US) 1993-01-07 WO claimed
EP-0507863-A1 SIGMA RECEPTOR LIGANDS AND THE USE THEREOF VIRGINIA COMMONWEALTH UNIVERSITY (US) 1992-10-14 EP claimed
WO-1991009594-A1 SIGMA RECEPTOR LIGANDS AND THE USE THEREOF VIRGINIA COMMONWEALTH UNIVERSITY (US) 1991-07-11 WO claimed
US-11912997-B2 RNAi agents for inhibiting expression of Superoxide Dismutase 1 (SOD1), compositions thereof, and methods of use Arrowhead Pharmaceuticals, Inc. (US) 2024-02-27 US disclosed
US-20240026363-A1 RNAi Agents for Inhibiting Expression of Superoxide Dismutase 1 (SOD1), Compositions Thereof, and Methods of Use SIXTH STREETLENDING PARTNERS, AS THE ADMINISTRATIVE AGENT 2024-01-25 US disclosed
US-20240018161-A1 MODULATORS OF CYSTIC FIBROSIS TRANSMEMBRANE CONDUCTANCE REGULATOR VERTEX PHARMA (US) 2024-01-18 US disclosed
US-20230373999-A1 KRAS G12C INHIBITORS MIRATI THERAPEUTICS INC (US) 2023-11-23 US disclosed
US-11773078-B2 Furin inhibitors GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2023-10-03 US disclosed
US-20230192591-A1 PROCESS FOR PREPARING TRIENTINE DIHYDROCHLORIDE COUGHLIN DANIEL J (US) 2023-06-22 US disclosed
WO-1993000313-A2 SIGMA RECEPTOR LIGANDS AND THE USE THEREOF VIRGINIA COMMONWEALTH UNIVERSITY (US) 1993-01-07 WO disclosed
US-5162310-A Calcium Metabolism Regulators CIBA-GEIGY CORPORATION (US) 1992-11-10 US disclosed
US-5157038-A Antidepressants; tranquilizers; treatment of schizophrenia and epilepsy; antilepmic agents RICHTER GEDEON VEGYESZETI GYAR RT. (HU) 1992-10-20 US disclosed
EP-0412820-A2 2-Oxo-1-oxa-8-azaspiro[4,5] decane derivatives, processes for their preparation and pharmaceutical compositions thereof RICHTER GEDEON VEGYESZETI GYAR R.T. (HU) 1991-02-13 EP disclosed
EP-0371921-A2 Phenyl aliphatyl amino alkane diphosphonic acids CIBA-GEIGY AG (CH) 1990-06-06 EP disclosed
US-4416831-A ANGIOTENSIN INHIBITORS E. R. SQUIBB & SONS, INC. (US) 1983-11-22 US disclosed
US-4374131-A HYPOTENSIVE AGENTS E. R. SQUIBB & SONS, INC. (US) 1983-02-15 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 (6 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-11912997-B2 RNAi agents for inhibiting expression of Superoxide Dismutase 1 (SOD1), compositions thereof, and methods of use SOD1, SOD3, SMN1; SMN2 SIGMAR1 2265/4885MAOA 1500/4885CHRM2 4783/4885
US-20240018161-A1 MODULATORS OF CYSTIC FIBROSIS TRANSMEMBRANE CONDUCTANCE REGULATOR CFTR, SCNN1G, SCNN1B SIGMAR1 1818/4885MAOA 4632/4885CHRM2 1067/4885
US-20240026363-A1 RNAi Agents for Inhibiting Expression of Superoxide Dismutase 1 (SOD1), Compositions Thereof, and Methods of Use SOD1, SOD3, SMN1; SMN2 SIGMAR1 2242/4885MAOA 1513/4885CHRM2 4786/4885
US-20230192591-A1 PROCESS FOR PREPARING TRIENTINE DIHYDROCHLORIDE SAMHD1, QDPR, DHPS SIGMAR1 3092/4885MAOA 1882/4885CHRM2 4843/4885
US-11773078-B2 Furin inhibitors FURIN, TGFB1, PCSK7 SIGMAR1 4873/4885MAOA 3656/4885CHRM2 3813/4885
US-20230373999-A1 KRAS G12C INHIBITORS KRAS, NRAS, HRAS SIGMAR1 4812/4885MAOA 4876/4885CHRM2 4880/4885

“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.