SCHEMBL74363

SCHEMBL74363

[CH2]/C=C/c1ccc(Cl)cc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AHR P35869 1/20 0.54
CYP1A2 P05177 2/20 0.50
HSD17B10 Q99714 2/20 0.48
FBP1 P09467 1/20 0.46
LMNA P02545 1/20 0.44
CYP2A6 P11509 1/20 0.44
ALOX5 P09917 1/20 0.43
PTGS1 P23219 1/20 0.43
PTGS2 P35354 1/20 0.43
NFE2L2 Q16236 1/20 0.43
MAOB P27338 2/20 0.42
HDAC2 Q92769 2/20 0.41
ALDH1A1 P00352 1/20 0.41
MAPK1 P28482 1/20 0.41
KDM4E B2RXH2 1/20 0.41
MAPT P10636 1/20 0.41
HDAC3 O15379 1/20 0.41
HDAC4 P56524 1/20 0.41
HDAC1 Q13547 1/20 0.41
HDAC7 Q8WUI4 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
SCHEMBL74364 1.00 AHR (0.54) AHRCYP1A2HSD17B10FBP1LMNA
SCHEMBL28022158 0.97 AHR (0.52) AHRCYP1A2HSD17B10FBP1LMNA
SCHEMBL29190657 0.82 HDAC3 (0.50) AHRCYP1A2HSD17B10FBP1LMNA
SCHEMBL699666 0.82 AHR (0.74) AHRCYP1A2HSD17B10FBP1LMNA
SCHEMBL9679429 0.82 AHR (0.74) AHRCYP1A2HSD17B10FBP1LMNA
SCHEMBL1795502 0.82 AHR (0.74) AHRCYP1A2HSD17B10FBP1LMNA
SCHEMBL20582895 0.82 AHR (0.74) AHRCYP1A2HSD17B10FBP1LMNA
SCHEMBL260347 0.82 AHR (0.74) AHRCYP1A2HSD17B10FBP1LMNA
SCHEMBL9679426 0.82 AHR (0.74) AHRCYP1A2HSD17B10FBP1LMNA
SCHEMBL10458457 0.82 AHR (0.74) AHRCYP1A2HSD17B10FBP1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20030232994-A1 Bicyclic thiophene derivatives and combinatorial libraries thereof LION BIOSCIENCE AG (DE) 2003-12-18 US claimed
WO-2002014261-A2 4-SUBSTITUTED D-GLUTAMIC ACID DERIVATIVES FOR USE AS ANTIBIOTIC ELI LILLY AND COMPANY (US) 2002-02-21 WO claimed
EP-0983507-A1 TRICYCLIC TETRAHYDROQUINOLINE DERIVATIVES AND TRICYCLIC TETRAHYDROQUINOLINE COMBINATORIAL LIBRARIES Trega Biosciences, Inc. (US) 2000-03-08 EP claimed
WO-1998034111-A1 TRICYCLIC TETRAHYDROQUINOLINE DERIVATIVES AND TRICYCLIC TETRAHYDROQUINOLINE COMBINATORIAL LIBRARIES TREGA BIOSCIENCES, INC. (US) 1998-08-06 WO claimed
US-5786448-A FOR SCREENING, SYNTHESIZING PEPTIDE DERIVATIVES TREGA BIOSCIENCES, INC. (US) 1998-07-28 US claimed
WO-1998019693-A1 COMBINATORIAL LIBRARIES OF CYCLIC UREA AND CYCLIC THIOUREA DERIVATIVES AND COMPOUNDS THEREIN TREGA BIOSCIENCES, INC. (US) 1998-05-14 WO claimed
US-5026838-A Starting materials for polynucleotides NIPPON ZEON CO., LTD. (JP) 1991-06-25 US claimed
US-4981873-A ANTICOAGULANTS BOEHRINGER MANNHEIM GMBH (DE) 1991-01-01 US claimed
US-4906768-A Process for production of oxime derivatives NIPPON ZEON CO., LTD. (JP) 1990-03-06 US claimed
EP-0065407-B1 PHARMACEUTICAL SPIRO-SUCCINIMIDE DERIVATIVES IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1985-03-13 EP claimed
EP-0065407-A2 Pharmaceutical spiro-succinimide derivatives IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1982-11-24 EP claimed
US-3956374-A Aryl-oxo-heptenoic acids MERCK & CO., INC. (US) 1976-05-11 US claimed
CN-114656380-B Method for simply synthesizing allyl thiomethyl ether 南阳师范学院 2023-06-02 CN disclosed
CN-115558686-A Method for synthesizing cinnamamide derivatives on line based on continuous flow bioreactor 浙江工业大学 2023-01-03 CN disclosed
CN-114656380-A Method for simply synthesizing allyl methyl sulfide 南阳师范学院 2022-06-24 CN disclosed
EP-1515969-B2 SPIROINDOLINEPIPERIDINE DERIVATIVES SYNGENTA LTD (GB) 2017-10-11 EP disclosed
EP-0065407-A2 Pharmaceutical spiro-succinimide derivatives IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1982-11-24 EP disclosed
US-4249027-A Process for the preparation of 5-substituted resorcinols and related intermediates CIBA-GEIGY CORPORATION (US) 1981-02-03 US disclosed
US-4045434-A Esters of nitro(tetrahydro-2H-1,3-thiazin-2-ylidene)acetic acids SHELL OIL COMPANY (US) 1977-08-30 US disclosed
US-4020098-A Process for the preparation of 5-substituted resorcinols and related intermediates CIBA-GEIGY CORPORATION (US) 1977-04-26 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-20030232994-A1 Bicyclic thiophene derivatives and combinatorial libraries thereof CXCR2, BICRA, CXCR1 AHR 1614/4885CYP1A2 199/4885HSD17B10 2104/4885

“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.