SCHEMBL461597

SCHEMBL461597

Nc1c(F)c(F)cc(F)c1F

nearest known ligand 0.43

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CA1 P00915 6/20 0.43
CA2 P00918 6/20 0.43
CA12 O43570 1/20 0.43
CA7 P43166 1/20 0.43
CA13 Q8N1Q1 1/20 0.43
CA4 P22748 2/20 0.38
ALDH1A1 P00352 3/20 0.35
CES2 O00748 2/20 0.35
CES1 P23141 2/20 0.35
LMNA P02545 2/20 0.34
HDAC1 Q13547 1/20 0.32
HDAC6 Q9UBN7 1/20 0.32
CA9 Q16790 3/20 0.31
KDM4E B2RXH2 1/20 0.30
HPGD P15428 1/20 0.30
CA3 P07451 1/20 0.30

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
Benzene SCHEMBL29240836 0.94 CA1 (0.40) CA1CA2CA12CA7CA13
Cyanide SCHEMBL28063239 0.91 CA1 (0.39) CA1CA2CA12CA7CA13
SCHEMBL859273 0.87 CA1 (0.40) CA1CA2CA12CA7CA13
SCHEMBL8919707 0.87 CA1 (0.40) CA1CA2CA12CA7CA13
SCHEMBL1462129 0.84 ALDH1A1 (0.36) CA1CA2CA12CA7CA13
SCHEMBL29690296 0.84 ALDH1A1 (0.36) CA1CA2CA12CA7CA13
SCHEMBL5515482 0.80 CA12 (0.35) CA1CA2CA12CA7CA13
SCHEMBL30952527 0.80 CA1 (0.40) CA1CA2CA12CA7CA13
SCHEMBL1032872 0.80 CA1 (0.40) CA1CA2CA12CA7CA13
SCHEMBL28988342 0.80 CA1 (0.46) CA1CA2CA12CA7CA13

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-122050911-A Stretchable conductive paste and manufacturing method thereof 苏州共同研材料有限公司 2026-05-15 CN claimed
EP-4211512-B1 ELECTROCHROMIC DEVICE UNIV BORDEAUX (FR) 2024-08-14 EP claimed
CN-118183708-A Method for preparing fluorocarbon material by using fluorine-containing polymer 重庆大学锂电及新材料遂宁研究院 2024-06-14 CN claimed
CN-117886710-A Synthesis method of roxburgh Bei Kao shake 武汉回盛生物科技股份有限公司 2024-04-16 CN claimed
CN-117886709-A Synthesis method of roxburgh Bei Kao shake 武汉回盛生物科技股份有限公司 2024-04-16 CN claimed
US-20240094589-A1 ELECTROCHROMIC DEVICE INSTITUT POLYTECHNIQUE DE BORDEAUX (FR) 2024-03-21 US claimed
EP-4211512-A1 ELECTROCHROMIC DEVICE UNIVERSITE DE BORDEAUX (FR) 2023-07-19 EP claimed
WO-2022053756-A1 ELECTROCHROMIC DEVICE Universite de Bordeaux (FR) 2022-03-17 WO claimed
CN-111793148-A Preparation method of reusable solid-phase extraction material based on beta cyclodextrin 福州海关技术中心 2020-10-20 CN claimed
CN-107915647-B Synthetic method of 2,3,5,6-tetrafluoroaniline 大连奇凯医药科技有限公司 2020-02-28 CN claimed
CN-1293036-C Process for the preparation of amines BAYER CHEMICALS AG (DE) 2007-01-03 CN claimed
WO-2006012642-A2 PYRROLE DERIVATIVES AS PHARMACEUTICAL AGENTS EXELIXIS, INC. (US) 2006-02-02 WO claimed
US-20050113582-A1 Method for producing amines LANXESS DEUTSCHLAND GMBH (DE) 2005-05-26 US claimed
CN-1608047-A Method for producing amines BAYER CHEMICALS AG (DE) 2005-04-20 CN claimed
EP-1472212-A1 METHOD FOR PRODUCING AMINES Bayer Chemicals AG (DE) 2004-11-03 EP claimed
WO-2003051817-A1 METHOD FOR PRODUCING AMINES BAYER CHEMICALS AG (DE) 2003-06-26 WO claimed
US-6521794-B2 Hydrolyzing and decarboxylating an aromatic cyano compound in an acidic substance NIPPON SHOKUBAI CO., LTD. (JP) 2003-02-18 US claimed
US-20020156322-A1 Method for production of aromatic compounds NIPPON SHOKUBAI CO., LTD. (JP) 2002-10-24 US claimed
EP-1229015-A1 Method for production of aromatic compounds Nippon Shokubai Co., Ltd. (JP) 2002-08-07 EP claimed
EP-0070130-A1 Improvement in or relating to benzoylphenyl urea derivatives ELI LILLY AND COMPANY (US) 1983-01-19 EP claimed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 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-20020156322-A1 Method for production of aromatic compounds DDC, PAH, MCCC2 CA1 525/4885CA2 331/4885CA12 164/4885
US-20050113582-A1 Method for producing amines HNMT, TYR, INMT CA1 1952/4885CA2 880/4885CA12 209/4885

“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.