SCHEMBL7117596

SCHEMBL7117596

CC(CS)Cc1ccccc1

nearest known ligand 0.58

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ ANPEP P15144 1/20 0.56
▸ TAAR1 Q96RJ0 5/20 0.54
▸ SIGMAR1 Q99720 4/20 0.54
▸ SLC6A2 P23975 2/20 0.54
▸ MAOA P21397 1/20 0.54
▸ SLC6A4 P31645 1/20 0.54
▸ SLC6A3 Q01959 1/20 0.54
▸ CYP2A6 P11509 1/20 0.54
▸ ADORA2A P29274 1/20 0.54
▸ ADORA1 P30542 1/20 0.54
▸ SLC18A2 Q05940 1/20 0.50
▸ CPA3 P15088 1/20 0.50
▸ CYP2D6 P10635 1/20 0.50
▸ FOLH1 Q04609 1/20 0.50
▸ MEN1 O00255 1/20 0.48
▸ KMT2A Q03164 1/20 0.48
▸ TRPA1 O75762 1/20 0.48
▸ EPHX1 P07099 1/20 0.46
▸ MME P08473 1/20 0.46

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
Bromide SCHEMBL9320180 0.98 ANPEP (0.54) ANPEPTAAR1SIGMAR1SLC6A2MAOA
SCHEMBL4785594 0.85 SIGMAR1 (0.64) TAAR1SIGMAR1SLC6A2MAOASLC6A4
SCHEMBL8072287 0.80 SIGMAR1 (0.58) TAAR1SIGMAR1SLC6A2MAOASLC6A4
Benzene SCHEMBL3082124 0.78 TRPA1 (0.57) TAAR1SIGMAR1SLC6A2MAOASLC6A4
SCHEMBL199315 0.78 TRPA1 (0.57) TAAR1SIGMAR1SLC6A2MAOASLC6A4
SCHEMBL28785111 0.78 SIGMAR1 (0.56) TAAR1SIGMAR1SLC6A2MAOASLC6A4
SCHEMBL919467 0.77 TSHR (0.46) MEN1KMT2A
SCHEMBL24325406 0.77 CYP1A2 (0.52) TAAR1SIGMAR1CYP2D6
SCHEMBL94628 0.76 TAAR1 (0.54) TAAR1SIGMAR1SLC6A2MAOASLC6A4
SCHEMBL6557693 0.76 SIGMAR1 (0.54) TAAR1SIGMAR1SLC6A2MAOASLC6A4

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 13 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1140058-B1 N-FORMYL HYDROXYLAMINE DERIVATIVES AS ANTIBACTERIAL AGENTS BRITISH BIOTECH PHARM (GB) 2003-11-05 — — EP claimed
US-10906904-B2 ADO-resistant cysteamine analogs and uses thereof HORIZON ORPHAN LLC (US) 2021-02-02 — — US disclosed
EP-1187819-A1 N-SUBSTITUTED PERHYDRO DIAZINE BASF AKTIENGESELLSCHAFT (DE) 2002-03-20 — — EP disclosed
EP-1187820-A1 SUBSTITUTED UREAS BASF AKTIENGESELLSCHAFT (DE) 2002-03-20 — — EP disclosed
EP-0638075-B1 THIAZOLE OR IMIDAZOLE DERIVATIVES AS MAILLARD REACTION INHIBITORS OTSUKA PHARMA CO LTD (JP) 2002-01-16 — — EP disclosed
WO-2001000602-A1 SUBSTITUTED UREAS BASF AKTIENGESELLSCHAFT (DE) 2001-01-04 — — WO disclosed
WO-2001000600-A1 N-SUBSTITUTED PERHYDRO DIAZINE BASF AKTIENGESELLSCHAFT (DE) 2001-01-04 — — WO disclosed
WO-1998043649-A2 AGE PRODUCTION INHIBITORY COMPOSITION COMPRISING A MAILLARD REACTION INHIBITOR AND VITAMIN B¿6? OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1998-10-08 — — WO disclosed
EP-0480052-B1 QUINOLINE DERIVATIVE, ANTIULCER DRUG CONTAINING THE SAME, AND PRODUCTION OF SAID DERIVATIVE OTSUKA PHARMA CO LTD (JP) 1998-01-14 — — EP disclosed
US-5677322-A THERAPY FOR AGING, DIABETES OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1997-10-14 — — US disclosed
US-5215999-A Quinoline derivative and antiulcer agent containing said quinoline derivative OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1993-06-01 — — US disclosed
EP-0480052-A1 QUINOLINE DERIVATIVE, ANTIULCER DRUG CONTAINING THE SAME, AND PRODUCTION OF SAID DERIVATIVE OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1992-04-15 — — EP disclosed
US-4423215-A REACTING ESTER, SODIUM IODIDE, 4-PYRIDINEETHANESULFONIC ACID AJINOMOTO COMPANY, INC. (JP) 1983-12-27 — — 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 (1 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-10906904-B2 ADO-resistant cysteamine analogs and uses thereof GLS, CTH, HNMT ANPEP 399/4885TAAR1 2067/4885SIGMAR1 2712/4885

“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.

Send feedback