SCHEMBL9100

SCHEMBL9100

NC(=O)CCCC1CCCCC1

nearest known ligand 0.50

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 1/20 0.50
CYP1A2 P05177 1/20 0.48
HPGD P15428 1/20 0.47
ALOX5 P09917 2/20 0.45
KDM5A P29375 3/20 0.45
PHF8 Q9UPP1 3/20 0.45
KDM2A Q9Y2K7 3/20 0.45
KDM4C Q9H3R0 2/20 0.45
KDM4A O75164 1/20 0.45
EPHX1 P07099 1/20 0.43
P2RX7 Q99572 1/20 0.42
NAAA Q02083 1/20 0.41
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
METAP1 P53582 1/20 0.41

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
SCHEMBL8392478 1.00 SIGMAR1 (0.50) SIGMAR1CYP1A2HPGDALOX5KDM5A
SCHEMBL2752775 0.98 SIGMAR1 (0.46) SIGMAR1CYP1A2HPGDALOX5KDM5A
SCHEMBL9203 0.93 SIGMAR1 (0.54) SIGMAR1CYP1A2HPGDALOX5KDM5A
SCHEMBL931403 0.93 SIGMAR1 (0.54) SIGMAR1CYP1A2HPGDALOX5KDM5A
SCHEMBL8392784 0.93 ALOX5 (0.43) SIGMAR1CYP1A2HPGDALOX5KDM5A
SCHEMBL13520 0.91 SIGMAR1 (0.57) SIGMAR1CYP1A2HPGDALOX5KDM5A
SCHEMBL9718136 0.91 SIGMAR1 (0.57) SIGMAR1CYP1A2HPGDALOX5KDM5A
SCHEMBL11010082 0.91 SIGMAR1 (0.57) SIGMAR1CYP1A2HPGDALOX5KDM5A
SCHEMBL8860844 0.91 SIGMAR1 (0.57) SIGMAR1CYP1A2HPGDALOX5KDM5A
SCHEMBL20408333 0.91 SIGMAR1 (0.57) SIGMAR1CYP1A2HPGDALOX5KDM5A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3917907-B1 MODULATORS OF POTASSIUM ION CHANNELS AND USES THEREOF UNIV DEGLI STUDI DI SALERNO (IT) 2025-05-21 EP claimed
CN-107567445-A It can be used as 2 phenyl 3H imidazos [4,5 B] pyridine derivates of mammal EGFR-TK ROR1 activities inhibitor 坎塞拉有限公司 2018-01-09 CN claimed
US-7595403-B2 Benzisothiazol-3-one-carboxylic acid amides as phospholipase inhibitors ELI LILLY AND COMPANY (US) 2009-09-29 US claimed
US-20060276522-A1 Benzisothiazol-3-one-carboxylic acid amides as phospholipase inhibitors ELI LILLY AND COMPANY (US) 2006-12-07 US claimed
US-7045634-B2 Prostamide receptor antagonists ALLERGAN, INC. (US) 2006-05-16 US claimed
EP-1615900-A1 BENZISOTHIAZOL-3-ONE-CARBOXYLIC ACID AMIDES AS PHOSPHOLIPASE INHIBITORS ELI LILLY AND COMPANY (US) 2006-01-18 EP claimed
WO-2005026172-A1 PROSTAMIDE RECEPTOR ANTAGONISTS ALLERGAN, INC. (US) 2005-03-24 WO claimed
US-20050054699-A1 Prostamide receptor antagonists ALLERGAN, INC. 2005-03-10 US claimed
WO-2004094394-A1 BENZISOTHIAZOL-3-ONE-CARBOXYLIC ACID AMIDES AS PHOSPHOLIPASE INHIBITORS ELI LILLY AND COMPANY (US) 2004-11-04 WO claimed
EP-1448177-A1 AMINO DIOLS USEFUL IN THE TREATMENT OF ALZHEIMER'S DISEASE Elan Pharmaceuticals, Inc. (US) 2004-08-25 EP claimed
WO-2003043618-A2 AMINO DIOLS USEFUL IN THE TREATMENT OF ALZHEIMER'S DISEASE ELAN PHARMACEUTICALS, INC. (US) 2003-05-30 WO claimed
EP-1073633-A2 SUBSTITUTED BETA-AMINO ACID INHIBITORS OF METHIONINE AMINOPEPTIDASE-2 ABBOTT LABORATORIES (US) 2001-02-07 EP claimed
WO-1999057098-A2 SUBSTITUTED BETA-AMINO ACID INHIBITORS OF METHIONINE AMINOPEPTIDASE-2 ABBOTT LABORATORIES (US) 1999-11-11 WO claimed
CN-116218464-A Adhesive for improving adhesive property of rubber and copper-plated steel wire and preparation method thereof 江苏国立化工科技有限公司 2023-06-06 CN disclosed
WO-2021252640-A1 ASPARAGINE DERIVATIVES AND METHODS OF USING SAME SENDA BIOSCIENCES, INC. (US) 2021-12-16 WO disclosed
US-10954236-B2 Tyrosine amide derivatives as Rho-Kinase inhibitors CHIESI FARMACEUTICI S.P.A. (IT) 2021-03-23 US disclosed
US-20050054699-A1 Prostamide receptor antagonists ALLERGAN, INC. 2005-03-10 US disclosed
WO-2004094394-A1 BENZISOTHIAZOL-3-ONE-CARBOXYLIC ACID AMIDES AS PHOSPHOLIPASE INHIBITORS ELI LILLY AND COMPANY (US) 2004-11-04 WO disclosed
US-5864043-A CARDIOVASCULAR DISORDERS AND ANGIOTENSIN ANTAGONIST KARL THOMAE GMBH (DE) 1999-01-26 US disclosed
US-5541229-A ANGIOITENSIN II ANTAGONIST AS HYPOTENSIVE AGENTS, ANTIISCHEMIC AGENTS AND CARDIOVASCULAR DISORDERS DR. KARL THOMAE GMBH (DE) 1996-07-30 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 (3 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-20050054699-A1 Prostamide receptor antagonists PTGIR, PTGER1, TBXA2R SIGMAR1 476/4885CYP1A2 412/4885HPGD 206/4885
US-10954236-B2 Tyrosine amide derivatives as Rho-Kinase inhibitors ROCK1, ROCK2, CIT SIGMAR1 3444/4885CYP1A2 760/4885HPGD 352/4885
US-20060276522-A1 Benzisothiazol-3-one-carboxylic acid amides as phospholipase inhibitors LIPG, PNLIP, LIPC SIGMAR1 3000/4885CYP1A2 2235/4885HPGD 1188/4885

“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.