SCHEMBL7095723

SCHEMBL7095723

O=C(O)c1cccc(C(F)(F)C(F)(F)F)c1C(=O)O

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX15 P16050 3/20 0.43
ALDH1A1 P00352 3/20 0.43
TAS2R14 Q9NYV8 2/20 0.43
FABP4 P15090 1/20 0.42
ALB P02768 1/20 0.41
LMNA P02545 2/20 0.41
AKR1C3 P42330 1/20 0.39
CA12 O43570 2/20 0.39
CA1 P00915 2/20 0.39
CA2 P00918 2/20 0.39
CA7 P43166 2/20 0.39
CA9 Q16790 2/20 0.39
CA14 Q9ULX7 2/20 0.39
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
TSHR P16473 1/20 0.38
NR4A1 P22736 1/20 0.38
NR4A2 P43354 1/20 0.38
NR4A3 Q92570 1/20 0.38
KDM4E B2RXH2 2/20 0.38

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
SCHEMBL7096331 0.90 TAS2R14 (0.39) ALOX15ALDH1A1TAS2R14FABP4ALB
SCHEMBL8977522 0.90 TAS2R14 (0.39) ALOX15ALDH1A1TAS2R14FABP4ALB
SCHEMBL7091349 0.88 TAS2R14 (0.38) ALOX15ALDH1A1TAS2R14FABP4ALB
SCHEMBL7092199 0.88 TAS2R14 (0.38) ALOX15ALDH1A1TAS2R14FABP4ALB
SCHEMBL30269555 0.87 TAS2R14 (0.42) ALOX15ALDH1A1TAS2R14FABP4ALB
SCHEMBL29404866 0.87 TAS2R14 (0.42) ALOX15ALDH1A1TAS2R14FABP4ALB
SCHEMBL145576 0.87 TAS2R14 (0.42) ALOX15ALDH1A1TAS2R14FABP4ALB
SCHEMBL9013418 0.86 ALDH1A1 (0.44) ALOX15ALDH1A1TAS2R14FABP4ALB
SCHEMBL2964734 0.86 TAS2R14 (0.51) ALOX15ALDH1A1TAS2R14FABP4ALB
SCHEMBL8713228 0.85 TAS2R14 (0.41) ALOX15ALDH1A1TAS2R14FABP4ALB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0881545-B1 Positively-chargeable charge control agent and toner for developing electrostatic images ORIENT CHEMICAL IND (JP) 2003-08-20 EP disclosed
US-6060615-A Positively-chargeable charge control agent and toner for developing electrostatic images ORIENT CHEMICAL INDUSTRIES, LTD. (JP) 2000-05-09 US disclosed
US-5981130-A Positively-chargeable charge control agent and toner for developing electrostatic images ORIENT CHEMICAL INDUSTRIES, LTD. (JP) 1999-11-09 US disclosed
EP-0881545-A1 Positively-chargeable charge control agent and toner for developing electrostatic images ORIENT CHEMICAL INDUSTRIES, LTD. (JP) 1998-12-02 EP disclosed