SCHEMBL17286707

SCHEMBL17286707

Cc1cc(C(C)(O)C(F)(F)F)c(C)cc1O

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX15 P16050 5/20 0.41
ALDH1A1 P00352 4/20 0.41
CYP2C9 P11712 4/20 0.41
CYP1A2 P05177 3/20 0.41
CYP2C19 P33261 3/20 0.41
CYP3A4 P08684 2/20 0.41
MAPK1 P28482 2/20 0.41
HIF1A Q16665 2/20 0.41
KDM4E B2RXH2 2/20 0.41
MAPT P10636 2/20 0.41
HSD17B10 Q99714 2/20 0.41
CYP2D6 P10635 2/20 0.41
G6PD P11413 1/20 0.41
PKM P14618 1/20 0.41
HPGD P15428 1/20 0.41
ALOX12 P18054 1/20 0.41
CCR6 P51684 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
AR P10275 4/20 0.39
ESR1 P03372 3/20 0.36

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
SCHEMBL15957692 0.92 AR (0.39) ALOX15ALDH1A1CYP2C9CYP1A2CYP2C19
SCHEMBL15957686 0.86 ALOX15 (0.41) ALOX15ALDH1A1CYP2C9CYP1A2CYP2C19
SCHEMBL15831663 0.83 PGK1 (0.47) CYP2C9CYP1A2CYP2C19ARSMN1; SMN2
SCHEMBL15957626 0.82 SMN1; SMN2 (0.43) ALOX15MAPK1KDM4EMAPTHSD17B10
SCHEMBL15957621 0.82 MAPK1 (0.43) ALOX15ALDH1A1CYP2C9CYP1A2CYP2C19
SCHEMBL15957658 0.81 AR (0.44) ALDH1A1CYP2C9CYP1A2CYP2C19AR
SCHEMBL17864634 0.79 ALDH1A1 (0.48) ALOX15ALDH1A1CYP2C9CYP1A2CYP2C19
SCHEMBL26601786 0.78 AR (0.38) ARSMN1; SMN2PGK1PGK2HSD11B1
SCHEMBL16838070 0.78 PGK1 (0.42) ARSMN1; SMN2HSP90AA1PGK1PGK2
SCHEMBL2287328 0.76 ALDH1A1 (0.50) ALOX15ALDH1A1CYP2C9CYP1A2CYP2C19

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9464163-B2 Novolak resin containing hexafluoroisopropanol group, method for producing same, and composition of same CENTRAL GLASS COMPANY, LIMITED (JP) 2016-10-11 US disclosed
US-20150337077-A1 Novolak Resin Containing Hexafluoroisopropanol Group, Method for Producing Same, and Composition of Same CENTRAL GLASS COMPANY, LIMITED (JP) 2015-11-26 US disclosed