SCHEMBL7096331

SCHEMBL7096331

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

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TAS2R14 Q9NYV8 2/20 0.39
FABP4 P15090 1/20 0.38
ALOX15 P16050 3/20 0.38
ALDH1A1 P00352 2/20 0.38
ALB P02768 1/20 0.37
LMNA P02545 2/20 0.37
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
AKR1C3 P42330 1/20 0.35
KDM4E B2RXH2 1/20 0.35
HPGD P15428 1/20 0.35
PLA2G2D Q9UNK4 1/20 0.35
PDK1 Q15118 1/20 0.35
PDK2 Q15119 1/20 0.35
PDK3 Q15120 1/20 0.35
PDK4 Q16654 1/20 0.35
DHODH Q02127 1/20 0.35
HDAC6 Q9UBN7 1/20 0.35
CA12 O43570 1/20 0.34
CA1 P00915 1/20 0.34

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
SCHEMBL7092199 0.98 TAS2R14 (0.38) TAS2R14FABP4ALOX15ALDH1A1ALB
SCHEMBL7091349 0.98 TAS2R14 (0.38) TAS2R14FABP4ALOX15ALDH1A1ALB
SCHEMBL7095723 0.90 ALOX15 (0.43) TAS2R14FABP4ALOX15ALDH1A1ALB
SCHEMBL8846924 0.86 ALDH1A1 (0.48) TAS2R14FABP4ALOX15ALDH1A1LMNA
SCHEMBL3423138 0.85 TAS2R14 (0.40) TAS2R14FABP4ALOX15ALDH1A1ALB
SCHEMBL7650475 0.84 ALDH1A1 (0.46) TAS2R14FABP4ALOX15ALDH1A1LMNA
SCHEMBL7652143 0.84 ALDH1A1 (0.46) TAS2R14FABP4ALOX15ALDH1A1LMNA
SCHEMBL7648634 0.84 ALDH1A1 (0.46) TAS2R14FABP4ALOX15ALDH1A1LMNA
SCHEMBL7649678 0.84 ALDH1A1 (0.46) TAS2R14FABP4ALOX15ALDH1A1LMNA
SCHEMBL145576 0.84 TAS2R14 (0.42) TAS2R14FABP4ALOX15ALDH1A1ALB

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 1 patent. 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