SCHEMBL1665737

SCHEMBL1665737

FCC(F)Cc1ccccc1

nearest known ligand 0.48

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 1/20 0.48
TAAR1 Q96RJ0 4/20 0.44
SLC6A2 P23975 2/20 0.44
SIGMAR1 Q99720 2/20 0.44
MAOA P21397 1/20 0.44
SLC6A4 P31645 1/20 0.44
SLC6A3 Q01959 1/20 0.44
OPRM1 P35372 1/20 0.44
KCNH2 Q12809 1/20 0.44
CYP2A6 P11509 1/20 0.44
ADORA2A P29274 1/20 0.44
ADORA1 P30542 1/20 0.44
GRIN2B Q13224 1/20 0.43
CYP1A2 P05177 1/20 0.43
LAP3 P28838 3/20 0.42
ANPEP P15144 2/20 0.42
MAOB P27338 1/20 0.42
SLC18A2 Q05940 1/20 0.41
CYP2D6 P10635 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
SCHEMBL30657566 0.87 EPHX1 (0.55) EPHX1TAAR1SLC6A2SIGMAR1MAOA
SCHEMBL16934139 0.81 KCNH2 (0.50) EPHX1TAAR1SLC6A2SIGMAR1MAOA
SCHEMBL28749751 0.78 EPHX1 (0.46) EPHX1TAAR1SLC6A2SIGMAR1MAOA
SCHEMBL21677972 0.78 TRPA1 (0.50) EPHX1TAAR1SLC6A2SIGMAR1MAOA
SCHEMBL5597658 0.78 TRPA1 (0.54) EPHX1TAAR1SLC6A2SIGMAR1MAOA
SCHEMBL5001745 0.78 EPHX1 (0.52) EPHX1TAAR1SLC6A2SIGMAR1MAOA
SCHEMBL4679591 0.78 EPHX1 (0.52) EPHX1TAAR1SLC6A2SIGMAR1MAOA
SCHEMBL22660956 0.78 EPHX1 (0.46) EPHX1TAAR1SLC6A2SIGMAR1MAOA
SCHEMBL5597661 0.78 TRPA1 (0.54) EPHX1TAAR1SLC6A2SIGMAR1MAOA
SCHEMBL16933867 0.78 KCNH2 (0.47) EPHX1TAAR1SLC6A2SIGMAR1MAOA

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 11 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4567018-A1 METHOD FOR PRODUCING FLUORINATED ORGANIC COMPOUND DAIKIN INDUSTRIES, LTD. (JP) 2025-06-11 EP disclosed
CN-119630628-A Process for producing fluorinated organic compound 大金工业株式会社 2025-03-14 CN disclosed
WO-2024029525-A1 METHOD FOR PRODUCING FLUORINATED ORGANIC COMPOUND ダイキン工業株式会社 2024-02-08 WO disclosed
CN-116949600-A Method for directly spinning high-low viscosity PET (polyethylene terephthalate) bicomponent fiber melt 江苏轩达高分子材料有限公司 2023-10-27 CN disclosed
EP-2311803-A1 Heterocyclic compounds suitable for treating disorders that respond to modulation of the dopamine D3 receptor Abbott GmbH & Co. KG (DE) 2011-04-20 EP disclosed
CN-1923951-A Diphenylacetylene liquid crystal compounds XIAN MODERN CHEMISTRY RES INST (CN) 2007-03-07 CN disclosed
US-5279764-A Dihalogenobenzene derivatives MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 1994-01-18 US disclosed
US-5230827-A DERIVATIVES OF 2,3-DIFLUOROBENZOIC ACID MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 1993-07-27 US disclosed
EP-0358741-B1 DERIVATIVES OF 2,3-DIFLUOROBENZOIC ACID MERCK PATENT GmbH (DE) 1993-02-10 EP disclosed
EP-0358741-A1 DERIVATIVES OF 2,3-DIFLUOROBENZOIC ACID. MERCK PATENT GMBH (DE) 1990-03-21 EP disclosed
WO-1989008688-A1 DERIVATIVES OF 2,3-DIFLUOROBENZOIC ACID MERCK Patent Gesellschaft mit beschränkter Haftung (DE) 1989-09-21 WO disclosed