SCHEMBL878709

SCHEMBL878709

COc1cccc(Cc2c[nH]c3ncc(-c4ccc(I)s4)cc23)c1

nearest known ligand 0.58

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
FGFR1 P11362 1/20 0.58
FGFR4 P22455 1/20 0.58
BRD4 O60885 1/20 0.49
NTRK1 P04629 1/20 0.45
KIT P10721 4/20 0.45
NEK1 Q96PY6 1/20 0.43
CYP2C9 P11712 2/20 0.42
CYP3A4 P08684 1/20 0.42
CSF1R P07333 1/20 0.41
DHFR P00374 1/20 0.40
RIPK1 Q13546 1/20 0.40
CYP2C19 P33261 1/20 0.40

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
SCHEMBL857919 0.88 FGFR1 (0.58) FGFR1FGFR4BRD4NTRK1KIT
SCHEMBL857698 0.84 FGFR1 (0.60) FGFR1FGFR4BRD4NTRK1KIT
SCHEMBL858280 0.82 FGFR1 (0.66) FGFR1FGFR4BRD4NTRK1KIT
SCHEMBL857207 0.80 FGFR1 (0.60) FGFR1FGFR4BRD4NTRK1KIT
SCHEMBL857961 0.80 FGFR1 (0.62) FGFR1FGFR4BRD4NTRK1KIT
SCHEMBL878730 0.78 FGFR1 (0.69) FGFR1FGFR4BRD4NTRK1KIT
SCHEMBL13911278 0.78 FGFR1 (0.57) FGFR1FGFR4BRD4NTRK1KIT
SCHEMBL858570 0.76 FGFR1 (0.57) FGFR1FGFR4BRD4NTRK1KIT
SCHEMBL878736 0.76 FGFR1 (0.57) FGFR1FGFR4BRD4NTRK1KIT
SCHEMBL857805 0.74 FGFR1 (1.00) FGFR1FGFR4CYP2C9CYP3A4CSF1R

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
US-8143271-B2 Compounds and methods for kinase modulation, and indications therefor PLEXXIKON INC. (US) 2012-03-27 US disclosed