SCHEMBL1006539

SCHEMBL1006539

CNc1c(C)cccc1C

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 2/20 0.45
CYP2A6 P11509 2/20 0.45
TSHR P16473 2/20 0.44
ACHE P22303 1/20 0.44
ALDH1A1 P00352 5/20 0.43
CA1 P00915 1/20 0.43
CA2 P00918 1/20 0.43
CA7 P43166 1/20 0.43
CA9 Q16790 1/20 0.43
LMNA P02545 2/20 0.41
MAPT P10636 2/20 0.41
CYP3A4 P08684 1/20 0.41
MAPK1 P28482 1/20 0.41
MC4R P32245 1/20 0.41
SCN4A P35499 1/20 0.41
MC3R P41968 1/20 0.41
HTR3A P46098 1/20 0.41
SCN5A Q14524 1/20 0.41
SCN9A Q15858 1/20 0.41
SCN3A Q9NY46 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
Hydrochloric Acid SCHEMBL2864880 0.97 CYP1A2 (0.43) CYP1A2CYP2A6TSHRACHEALDH1A1
SCHEMBL27839905 0.97 CYP1A2 (0.43) CYP1A2CYP2A6TSHRACHEALDH1A1
Benzene SCHEMBL28199279 0.97 CYP1A2 (0.43) CYP1A2CYP2A6TSHRACHEALDH1A1
SCHEMBL8439291 0.87 CD44 (0.52) CYP1A2CYP2A6TSHRACHEALDH1A1
SCHEMBL4648220 0.84 RAPGEF4 (0.41) CYP1A2CYP2A6TSHRACHEALDH1A1
SCHEMBL9228264 0.82 ACHE (0.50) CYP1A2CYP2A6TSHRACHEALDH1A1
SCHEMBL10814735 0.82 TRPA1 (0.52) CYP1A2TSHRALDH1A1CA1CA2
SCHEMBL11426617 0.82 ALDH1A1 (0.50) CYP1A2CYP2A6TSHRACHEALDH1A1
SCHEMBL11663384 0.82 GAA (0.52) ALDH1A1MAPTL3MBTL1GAAMEN1
SCHEMBL8229219 0.82 CD44 (0.52) CYP1A2CYP2A6TSHRACHEALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118955264-A Method for preparing p-benzoquinone compound by oxidizing aniline compound 浙江大学 2024-11-15 CN claimed
US-20200369689-A1 Arylaminosilane Compound, Propylene Polymerization Catalyst And Preparation Thereof PETROCHINA COMPANY LIMITED (CN) 2020-11-26 US claimed
CN-111978346-A Arylamine silane compound, propylene polymerization catalyst, preparation and application thereof 中国石油天然气股份有限公司 2020-11-24 CN claimed
EP-2313481-A2 PRODUCTION PROCESS OF UNLEADED HIGH OCTANE NUMBER GASOLINE, AND SO OBTAINED GASOLINES CHIMEC S.P.A. (IT) 2011-04-27 EP claimed
WO-2010001341-A2 PRODUCTION PROCESS OF UNLEADED HIGH OCTANE NUMBER GASOLINE, AND SO OBTAINED GASOLINES CHIMEC S.P.A. (IT) 2010-01-07 WO claimed
US-12503593-B2 Curable thermosetting composition including poly(arylene ether) copolymer SHPP GLOBAL TECHNOLOGIES B.V. (NL) 2025-12-23 US disclosed
WO-2025224622-A1 POLYFUNCTIONAL POLY(ARYLENE ETHER) AND METHOD FOR THE MANUFACTURE THEREOF SHPP GLOBAL TECHNOLOGIES B.V. (NL) 2025-10-30 WO disclosed
WO-2025224628-A1 POLYFUNCTIONAL POLY(ARYLENE ETHERS) AND CURABLE COMPOSITIONS THEREOF SHPP GLOBAL TECHNOLOGIES B.V. (NL) 2025-10-30 WO disclosed
WO-2025224626-A1 THERMOPLASTIC POLYURETHANE AND ASSOCIATED METHOD AND ARTICLE SHPP GLOBAL TECHNOLOGIES B.V. (NL) 2025-10-30 WO disclosed
US-20250333561-A1 POLY(ARYLENE ETHER) COMPOSITIONS SHPP GLOBAL TECH BV (NL) 2025-10-30 US disclosed
WO-2025224623-A1 POLYFUNCTIONAL POLY(ARYLENE ETHERS) AND COPOLYMERS THEREOF SHPP GLOBAL TECHNOLOGIES B.V. (NL) 2025-10-30 WO disclosed
WO-2025224624-A1 CURABLE COMPOSITION AND CURED COMPOSITIONS DERIVED THEREFROM SHPP GLOBAL TECHNOLOGIES B.V. (NL) 2025-10-30 WO disclosed
US-4237068-A Primary aminoacylanilides ASTRA PHARMACEUTICAL PRODUCTS, INC. (US) 1980-12-02 US disclosed
US-4218477-A LONG LASTING ORAL AGENTS ASTRA PHARMACEUTICAL PRODUCTS, INC. (US) 1980-08-19 US disclosed
US-4188341-A Process for the production of (substituted) 2,6-dimethylanilines CIBA-GEIGY CORPORATION (US) 1980-02-12 US disclosed
US-4117165-A ANTIULCER, HYPOTENSIVE AGENTS WILLIAM H. RORER, INC. (US) 1978-09-26 US disclosed
US-4115564-A Treatment of diarrhea with amidinoureas WILLIAM H. RORER, INC. (US) 1978-09-19 US disclosed
US-4101575-A FUNGICIDES, BACTERICIDES BAYER AKTIENGESELLSCHAFT (DE) 1978-07-18 US disclosed
US-4093742-A Anti-hypertensive polyhaloisopropyl-substituted arylureas SCHERING CORPORATION (US) 1978-06-06 US disclosed
US-4025652-A ANTIDIARRHEA AGENTS WILLIAM H. RORER, INC. (US) 1977-05-24 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-20200369689-A1 Arylaminosilane Compound, Propylene Polymerization Catalyst And Preparation Thereof RPS8, PARP8, PRMT8 CYP1A2 1541/4885CYP2A6 2708/4885TSHR 912/4885

“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.