SCHEMBL1263587

SCHEMBL1263587

C=CC(=O)OCC(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)F

nearest known ligand 0.45

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
TSHR P16473 9/20 0.45
USP2 O75604 1/20 0.45
MAPT P10636 1/20 0.45
ALDH1A1 P00352 4/20 0.43
TP53 P04637 3/20 0.43
HIF1A Q16665 3/20 0.43
CYP3A4 P08684 2/20 0.43
MAPK1 P28482 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
HSD17B10 Q99714 1/20 0.35
CYP1A2 P05177 1/20 0.35
CYP2C9 P11712 1/20 0.35
CYP2C19 P33261 1/20 0.35
RECQL P46063 1/20 0.35
THRB P10828 1/20 0.34
HPGD P15428 1/20 0.33
KDM4E B2RXH2 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
GAA P10253 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
SCHEMBL710565 1.00 TSHR (0.45) TSHRUSP2MAPTALDH1A1TP53
SCHEMBL2032533 1.00 TSHR (0.45) TSHRUSP2MAPTALDH1A1TP53
SCHEMBL1263585 1.00 TSHR (0.45) TSHRUSP2MAPTALDH1A1TP53
SCHEMBL184582 1.00 TSHR (0.45) TSHRUSP2MAPTALDH1A1TP53
SCHEMBL10591032 0.98 TSHR (0.44) TSHRUSP2MAPTALDH1A1TP53
SCHEMBL1263184 0.98 ALDH1A1 (0.44) TSHRUSP2MAPTALDH1A1TP53
SCHEMBL37167 0.93 ALDH1A1 (0.46) TSHRUSP2MAPTALDH1A1TP53
SCHEMBL30927588 0.88 USP2 (0.38) TSHRUSP2MAPTALDH1A1TP53
SCHEMBL31453082 0.88 TSHR (0.38) TSHRUSP2MAPTALDH1A1TP53
SCHEMBL12703438 0.88 ALDH1A1 (0.53) TSHRALDH1A1TP53HIF1ACYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7881648-B2 Positive charge control resin for electrophotographic functional component parts, developing roller, and electrophotographic apparatus CANON KASEI KABUSHIKI KAISHA (JP) 2011-02-01 US disclosed
US-20080247787-A1 Positive Charge Control Resin for Electrophotographic Functional Component Parts, Developing Roller, and Electrophotographic Apparatus CANON KASEI KABUSHIKI KAISHA (JP) 2008-10-09 US disclosed
WO-2006134788-A1 POSITIVE CHARGE CONTROL RESIN FOR ELECTROPHOTOGRAPHIC FUNCTIONAL COMPONENT PARTS, DEVELOPING ROLLER, AND ELECTROPHOTOGRAPHIC APPARATUS CANON KASEI KABUSHIKI KAISHA (JP) 2006-12-21 WO disclosed