SCHEMBL692060

SCHEMBL692060

C1=COc2ccccc2N=C1

nearest known ligand 0.41

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
TRPA1 O75762 4/20 0.41
CYP1A2 P05177 1/20 0.31
CYP2D6 P10635 1/20 0.31

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
SCHEMBL22001 0.77 TRPA1 (0.43) TRPA1CYP1A2CYP2D6
SCHEMBL27882257 0.76 TRPA1 (0.42) TRPA1CYP1A2CYP2D6
SCHEMBL30218263 0.70 TRPA1 (0.32) TRPA1
SCHEMBL29394860 0.70 TRPA1 (0.32) TRPA1
SCHEMBL18894037 0.69
SCHEMBL2500373 0.68 TRPA1 (0.34) TRPA1CYP1A2CYP2D6
SCHEMBL11443028 0.65 TRPA1 (0.36) TRPA1
SCHEMBL11443029 0.65 TRPA1 (0.36) TRPA1
SCHEMBL15704080 0.65 MAOA (0.34)
SCHEMBL3092641 0.65 TRPA1 (0.41) TRPA1CYP1A2CYP2D6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116832869-A Magnetic nano bimetallic catalyst and preparation method and catalytic application thereof 河北师范大学 2023-10-03 CN claimed
EP-2560973-B1 MODULATORS OF 5-HT RECEPTORS AND METHODS OF USE THEREOF ABBVIE INC (US) 2016-11-16 EP claimed
EP-2560973-A1 MODULATORS OF 5-HT RECEPTORS AND METHODS OF USE THEREOF Abbvie Inc. (US) 2013-02-27 EP claimed
EP-2421870-A2 MODULATORS OF 5-HT RECEPTORS AND METHODS OF USE THEREOF Abbott Laboratories (US) 2012-02-29 EP claimed
WO-2011133182-A1 MODULATORS OF 5-HT RECEPTORS AND METHODS OF USE THEREOF ABBOTT LABORATORIES (US) 2011-10-27 WO claimed
EP-0673371-A1 BENZAZEPINONE DERIVATIVES Novartis AG (CH) 1995-09-27 EP claimed
WO-1994013651-A1 BENZAZEPINONE DERIVATIVES CIBA-GEIGY AG (CH) 1994-06-23 WO claimed
EP-4611792-A1 THERAPEUTIC REGIMENS AND METHODS FOR TREATMENT OF CARDIOVASCULAR RISK FACTORS USING A GLP-1R AND GCGR AGONIST Spitfire Pharma LLC (US) 2025-09-10 EP disclosed
WO-2025129168-A1 TRIAZOLONE INHIBITORS OF NICOTINAMIDE N-METHYLTRANSFERASE AND THEIR THERAPEUTIC USES THE UNITED STATES OF AMERICA, AS REPRESENTED BY THE SECRETARY, DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) 2025-06-19 WO disclosed
US-12281101-B2 Bicyclic lactams and methods of use thereof GENENTECH, INC. (US) 2025-04-22 US disclosed
CN-119859127-A Benzooxazepines and benzoxazoles Synthesis method and application of class compound 东北林业大学 2025-04-22 CN disclosed
US-12091425-B2 Compounds that inhibit MCL-1 protein AMGEN INC. (US) 2024-09-17 US disclosed
US-12024529-B2 Compounds that inhibit MCL-1 protein AMGEN INC. (US) 2024-07-02 US disclosed
WO-1990006309-A1 HETEROAZABENZOBICYCLIC CARBOXAMIDE 5-HT3, ANTAGONISTS RORER INTERNATIONAL (OVERSEAS) INC. (US) 1990-06-14 WO disclosed
US-4933445-A Heteroazabenzobicyclic carboxamide 5-HT3 antagonists RORER PHARMACEUTICAL CORPORATION (US) 1990-06-12 US disclosed
US-4251534-A Antihypertensive polyfluorohydroxyisopropyl bicyclic and tricyclic carbostyrils E. I. DU PONT DE NEMOURS AND COMPANY (US) 1981-02-17 US disclosed
US-4238607-A ANTIBIOTICS, SEDATIVES, HYPOTENSIVE AGENTS, AND ANTIDEPRESSANTS ENDO LABORATORIES INC. (US) 1980-12-09 US disclosed
US-4183936-A SEDATIVES, ANTIDEPRESSANTS, HYPOTENSIVE AGENTS, BACTERICIDES ENDO LABORATORIES, INC. (US) 1980-01-15 US disclosed
US-4115577-A SEDATIVES, ANTIDEPRESSANT ANTIHYPERTENSIVE, ANTIBACTERIAL ENDO LABORATORIES, INC. (US) 1978-09-19 US disclosed
US-4013652-A SEDATIVES ENDO LABORATORIES, INC. (US) 1977-03-22 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-12281101-B2 Bicyclic lactams and methods of use thereof LSS, LPXN, CYP1B1 TRPA1 4789/4885CYP1A2 61/4885CYP2D6 159/4885
US-12024529-B2 Compounds that inhibit MCL-1 protein MCL1, BCL2L1, BCL9 TRPA1 4777/4885CYP1A2 3890/4885CYP2D6 3837/4885
US-12091425-B2 Compounds that inhibit MCL-1 protein MCL1, BCL9, BCL2L1 TRPA1 4793/4885CYP1A2 4131/4885CYP2D6 4050/4885

“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.