SCHEMBL1994152

SCHEMBL1994152

CC(=O)Oc1cc(C(F)(F)F)ccc1C(F)(F)F

nearest known ligand 0.71

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 5/20 0.71
ALDH1A1 P00352 4/20 0.71
HPGD P15428 3/20 0.71
HSD17B10 Q99714 3/20 0.71
CYP2C19 P33261 2/20 0.71
USP2 O75604 1/20 0.71
BACE1 P56817 1/20 0.54
CES2 O00748 2/20 0.51
CYP1A2 P05177 1/20 0.42
CYP2C9 P11712 1/20 0.42
CFD P00746 2/20 0.41
SRD5A2 P31213 1/20 0.41
CFTR P13569 1/20 0.41
RXRA P19793 1/20 0.40
RXRB P28702 1/20 0.40
RXRG P48443 1/20 0.40
CYP1A1 P04798 1/20 0.40
CYP1B1 Q16678 1/20 0.40
TSHR P16473 2/20 0.40
ESR1 P03372 1/20 0.40

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
SCHEMBL4981997 0.86 KDM4E (0.62) KDM4EALDH1A1HPGDHSD17B10CYP2C19
SCHEMBL15453988 0.86 CES2 (0.55) KDM4EALDH1A1HPGDHSD17B10CYP2C19
SCHEMBL15453673 0.83 KDM4E (0.51) KDM4EALDH1A1HPGDHSD17B10CYP2C19
Triflusal SCHEMBL29435450 0.83 KDM4E (1.00) KDM4EALDH1A1HPGDHSD17B10CYP2C19
Triflusal SCHEMBL136423 0.83 KDM4E (1.00) KDM4EALDH1A1HPGDHSD17B10CYP2C19
Triflusal SCHEMBL29435449 0.83 KDM4E (1.00) KDM4EALDH1A1HPGDHSD17B10CYP2C19
SCHEMBL24436828 0.83 CYP2C19 (0.67) KDM4EALDH1A1HPGDHSD17B10CYP2C19
SCHEMBL4976918 0.83 CYP2C19 (0.67) KDM4EALDH1A1HPGDHSD17B10CYP2C19
SCHEMBL17355733 0.83 KDM4E (0.50) KDM4EALDH1A1HPGDHSD17B10CYP2C19
SCHEMBL24445659 0.83 KDM4E (0.50) KDM4EALDH1A1HPGDHSD17B10CYP2C19

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8952083-B2 Fluorocopolymer composition and its production process ASAHI GLASS COMPANY, LIMITED (JP) 2015-02-10 US claimed
US-8952083-B2 Fluorocopolymer composition and its production process ASAHI GLASS COMPANY, LIMITED (JP) 2015-02-10 US disclosed
US-20130244122-A1 NONAQUEOUS ELECTROLYTIC SOLUTION AND NONAQUEOUS-ELECTROLYTE BATTERY EMPLOYING THE SAME ONUKI MASAMICHI (JP) 2013-09-19 US disclosed
EP-2338935-B1 FLUORINE-CONTAINING COPOLYMER COMPOSITION AND PROCESS FOR PRODUCTION THEREOF ASAHI GLASS CO LTD (JP) 2012-12-12 EP disclosed
US-20120219866-A1 NONAQUEOUS ELECTROLYTIC SOLUTION AND NONAQUEOUS-ELECTROLYTE BATTERY EMPLOYING THE SAME MITSUBISHI CHEMICAL CORPORATION (JP) 2012-08-30 US disclosed
EP-2475041-A1 NON-AQUEOUS ELECTROLYTIC SOLUTION, AND NON-AQUEOUS ELECTROLYTE BATTERY COMPRISING SAME Mitsubishi Chemical Corporation (JP) 2012-07-11 EP disclosed
US-20110172336-A1 FLUOROCOPOLYMER COMPOSITION AND ITS PRODUCTION PROCESS ASAHI GLASS COMPANY, LIMITED (JP) 2011-07-14 US disclosed
EP-2338935-A1 FLUORINE-CONTAINING COPOLYMER COMPOSITION AND PROCESS FOR PRODUCTION THEREOF ASAHI GLASS COMPANY, LIMITED (JP) 2011-06-29 EP disclosed