SCHEMBL379614

SCHEMBL379614

C1=CC=Nc2ccccc2C=C1

nearest known ligand 0.33

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
TRPA1 O75762 3/20 0.33

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
SCHEMBL379612 1.00 TRPA1 (0.33) TRPA1
Fluoride SCHEMBL28557472 0.98 TRPA1 (0.32) TRPA1
SCHEMBL27595489 0.82 TRPA1 (0.33) TRPA1
SCHEMBL29394860 0.77 TRPA1 (0.32) TRPA1
SCHEMBL30218263 0.77 TRPA1 (0.32) TRPA1
SCHEMBL23446692 0.75 NQO2 (0.31)
SCHEMBL2186641 0.74 KDM4E (0.33) TRPA1
SCHEMBL2186647 0.74 KDM4E (0.33) TRPA1
SCHEMBL9523683 0.74 TRPA1 (0.36) TRPA1
SCHEMBL9523696 0.74 TRPA1 (0.36) TRPA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2025111482-A1 COMPLEXING AGENT SALT FORMULATIONS OF PHARMACEUTICAL COMPOUNDS AT LOW STOICHIOMETRIC RATIOS BEXSON BIOMEDICAL, INC. (US) 2025-05-30 WO claimed
US-20200297700-A1 BICYCLIC COMPOUND, PRODUCTION AND USE THEREOF TOBIRA THERAPEUTICS INC (US) 2020-09-24 US claimed
US-20170105969-A1 CENICRIVIROC FOR THE TREATMENT OF HIV-2 INFECTION TOBIRA THERAPEUTICS, INC. 2017-04-20 US claimed
EP-3148538-A1 CENICRIVIROC FOR THE TREATMENT OF HIV-2 INFECTION Tobira Therapeutics, Inc. (US) 2017-04-05 EP claimed
WO-2016123541-A2 CENICRIVIROC FOR THE TREATMENT OF ENCEPHALITIS INFECTION TOBIRA THERAPEUTICS, INC. (US) 2016-08-04 WO claimed
WO-2015187663-A1 CENICRIVIROC FOR THE TREATMENT OF HIV-2 INFECTION TOBIRA THERAPEUTICS, INC. (US) 2015-12-10 WO claimed
US-8362058-B2 Bicyclic compound, production and use thereof TOBIRA THERAPEUTICS, INC. (US) 2013-01-29 US claimed
US-8183273-B2 8-[4-(2-butoxyethoxy)phenyl]-1-isobutyl-N-[4-[[N-methyl-N-(tetrahydropyran-4-yl)amino]methyl]phenyl]-1,2,3,4-tetrahydro-1-benzazocine-5-carboxamide; HIV infectious diseases, chronic rheumatoid arthritis, autoimmune disease, allergic diseases, ischemic brain cell disease TOBIRA THERAPEUTICS, INC. (US) 2012-05-22 US claimed
EP-1144369-B1 ACETYLENIC ARYL SULFONAMIDE AND PHOSPHINIC ACID AMIDE HYDROXAMIC ACID TACE INHIBITORS WYETH CORP (US) 2004-07-21 EP claimed
US-6762178-B2 FOR USE IN TREATMENT OF DISEASE CONDITIONS MEDIATED BY TNF-ALPHA, SUCH AS RHEUMATOID ARTHRITIS, OSTEOARTHRITIS, SEPSIS, AIDS, ULCERATIVE COLITIS, MULTIPLE SCLEROSIS, CROHN'S DISEASE, DEGENERATIVE CARTILAGE LOSS WYETH HOLDINGS CORPORATION 2004-07-13 US claimed
US-20010056088-A1 Acetylenic aryl sulfonamide and phosphinic acid amide hydroxamic acid TACE inhibitors AMERICAN CYANAMID COMPANY (US) 2001-12-27 US claimed
EP-1144369-A2 ACETYLENIC ARYL SULFONAMIDE AND PHOSPHINIC ACID AMIDE HYDROXAMIC ACID TACE INHIBITORS American Cyanamid Company (US) 2001-10-17 EP claimed
WO-2000044710-A2 ACETYLENIC ARYL SULFONAMIDE AND PHOSPHINIC ACID AMIDE HYDROXAMIC ACID TACE INHIBITORS AMERICAN CYANAMID COMPANY (US) 2000-08-03 WO claimed
US-4166174-A ANALGESICS CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 1979-08-28 US claimed
JP-53009322-A None JP disclosed
JP-59013760-A None JP disclosed
JP-56083477-A None JP disclosed
US-3951984-A 3-Benzazocine compounds SUMITOMO CHEMICAL COMPANY, LIMITED (JA) 1976-04-20 US disclosed
US-3936462-A CNS DEPRESSANT, ANALGESIC STERLING DRUG INC. (US) 1976-02-03 US disclosed
US-3932422-A ANALGESICS, NARCOTIC ANTAGONISTS STERLING DRUG INC. (US) 1976-01-13 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-20170105969-A1 CENICRIVIROC FOR THE TREATMENT OF HIV-2 INFECTION CCR5, CCR2, CCR1 TRPA1 2347/4885
US-20200297700-A1 BICYCLIC COMPOUND, PRODUCTION AND USE THEREOF CCR5, CCR1, CCR2 TRPA1 68/4885
US-20010056088-A1 Acetylenic aryl sulfonamide and phosphinic acid amide hydroxamic acid TACE inhibitors PTDSS1, SAT1, TNF TRPA1 3821/4885

“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.