SCHEMBL7592464

SCHEMBL7592464

O=C(OC1CC1)c1cc(I)c(F)c(F)c1F

nearest known ligand 0.41

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ SERPINE1 P05121 2/20 0.41
▸ PTPN2 P17706 4/20 0.40
▸ PTPN1 P18031 4/20 0.40
▸ PTPRF P10586 1/20 0.40
▸ ATM Q13315 1/20 0.35
▸ KMT2A Q03164 2/20 0.34
▸ NPC1 O15118 2/20 0.33
▸ RAB9A P51151 2/20 0.33
▸ MEN1 O00255 1/20 0.33
▸ HTR3A P46098 3/20 0.32
▸ SCN1A P35498 2/20 0.32
▸ SCN2A Q99250 2/20 0.32
▸ SCN3A Q9NY46 2/20 0.32
▸ PTPN6 P29350 1/20 0.32
▸ CFTR P13569 1/20 0.32
▸ MAPT P10636 1/20 0.31
▸ SMN1; SMN2 Q16637 1/20 0.31

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
SCHEMBL7589538 0.94 MEN1 (0.40) SERPINE1PTPN2PTPN1PTPRFKMT2A
SCHEMBL7595670 0.94 SERPINE1 (0.39) SERPINE1PTPN2PTPN1PTPRFATM
SCHEMBL7593299 0.92 NPC1 (0.42) SERPINE1PTPN2PTPN1PTPRFKMT2A
SCHEMBL7593244 0.79 SERPINE1 (0.44) SERPINE1PTPN2PTPN1PTPRFATM
SCHEMBL7590157 0.78 SERPINE1 (0.39) SERPINE1ATMKMT2ANPC1RAB9A
SCHEMBL7597704 0.75 CFTR (0.53) ATMKMT2ACFTRMAPT
SCHEMBL7592447 0.75 TDP1 (0.48) KMT2ANPC1RAB9AMEN1MAPT
SCHEMBL7596432 0.73 SERPINE1 (0.41) SERPINE1PTPN2PTPN1PTPRFATM
SCHEMBL7593192 0.73 NPC1 (0.39) SERPINE1PTPN2PTPN1PTPRFKMT2A
SCHEMBL7590506 0.72 GPR35 (0.39) SERPINE1KMT2ANPC1RAB9AMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0968994-B1 PROCESS FOR PRODUCING SUBSTITUTED TRIFLUOROBENZOIC ACIDS AND ESTERS THEREOF UBE INDUSTRIES (JP) 2002-11-06 — — EP claimed
EP-0968994-A1 SUBSTITUTED TRIFLUOROBENZOIC ACIDS, ESTERS THEREOF, AND PROCESS FOR PRODUCING THE SAME UBE INDUSTRIES, LTD. (JP) 2000-01-05 — — EP claimed
EP-0968994-B1 PROCESS FOR PRODUCING SUBSTITUTED TRIFLUOROBENZOIC ACIDS AND ESTERS THEREOF UBE INDUSTRIES (JP) 2002-11-06 — — EP disclosed
US-6307091-B1 TRIFLUOROMETHYLATING A TRIFLUOROIODOBENZOIC ACID ESTER WITH ADIFLUORO(FLUOROSULFONYL)ACETIC ACID ESTER IN THE PRESENCE OF A COPPER CATALYST IN AN ORGANIC SOLVENT. UBE INDUSTRIES, LTD. (JP) 2001-10-23 — — US disclosed
US-6160171-A Trifluoro-substituted benzoic acid, esters thereof, and process for producing the same UBE INDUSTRIES, LTD. (JP) 2000-12-12 — — US disclosed
EP-0968994-A1 SUBSTITUTED TRIFLUOROBENZOIC ACIDS, ESTERS THEREOF, AND PROCESS FOR PRODUCING THE SAME UBE INDUSTRIES, LTD. (JP) 2000-01-05 — — EP disclosed
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