SCHEMBL3690339

SCHEMBL3690339

C=Cc1ccc(OC(C)(C)C)cc1C(F)(F)F

nearest known ligand 0.34

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
KIF11 P52732 1/20 0.34
AR P10275 4/20 0.32
APP P05067 1/20 0.32
S1PR1 P21453 1/20 0.32
HSD11B1 P28845 1/20 0.31
MAPK8 P45983 1/20 0.31
MAPK10 P53779 1/20 0.31
SRD5A1 P18405 1/20 0.31
GPR3 P46089 1/20 0.30
AGER Q15109 1/20 0.30
TRPV1 Q8NER1 1/20 0.30

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
SCHEMBL17921276 0.79 CYP1A1 (0.39) KIF11SRD5A1
SCHEMBL3203388 0.77 KIF11 (0.37) KIF11SRD5A1
SCHEMBL3628375 0.77 KIF11 (0.37) KIF11SRD5A1
SCHEMBL20224935 0.76 KIF11 (0.36) KIF11SRD5A1
SCHEMBL7709174 0.76 FBP1 (0.38) KIF11SRD5A1
SCHEMBL6764131 0.75 HTR2A (0.43) KIF11ARHSD11B1
SCHEMBL28486895 0.74 AR (0.56) AR
SCHEMBL6764202 0.74 IDO1 (0.45) ARHSD11B1
SCHEMBL4874384 0.73 KIF11 (0.34) KIF11SRD5A1
SCHEMBL21880623 0.73 SMN1; SMN2 (0.38) KIF11ARAPPS1PR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1720063-B1 Resin containing ketene-aldehyde copolymer NIPPON SODA CO (JP) 2010-04-07 EP disclosed
EP-1482361-B1 ACID-DEGRADABLE RESIN COMPOSITIONS CONTAINING KETENE-ALDEHYDE COPOLYMER NIPPON SODA CO (JP) 2007-10-03 EP disclosed
EP-1720063-A1 Resin containing ketene-aldehyde copolymer NIPPON SODA CO., LTD. (JP) 2006-11-08 EP disclosed
US-7105272-B2 Acid-degradable resin compositions containing ketene-aldehyde copolymer NIPPON SODA CO., LTD. (JP) 2006-09-12 US disclosed
US-20050130057-A1 Acid-degradable resin compositions containing ketene-aldehyde copolymer NIPPON SODA CO., LTD. (JP) 2005-06-16 US disclosed
EP-1482361-A1 ACID-DEGRADABLE RESIN COMPOSITIONS CONTAINING KETENE-ALDEHYDE COPOLYMER NIPPON SODA CO., LTD. (JP) 2004-12-01 EP disclosed