SCHEMBL17059482

SCHEMBL17059482

CCC(C)(C)Sc1ccc2nccc(Nc3ccc4scnc4c3)c2c1

nearest known ligand 0.58

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
RIPK2 O43353 16/20 0.58
KDR P35968 2/20 0.58
RIPK3 Q9Y572 7/20 0.56
RIPK1 Q13546 3/20 0.56
EGFR P00533 1/20 0.50
TGFBR1 P36897 1/20 0.50
BRAF P15056 1/20 0.44
PDGFRA P16234 1/20 0.44
ACVR1B P36896 1/20 0.44
PIK3CA P42336 1/20 0.44

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
SCHEMBL2595096 0.91 RIPK2 (0.57) RIPK2KDRRIPK3RIPK1EGFR
SCHEMBL2594915 0.90 RIPK2 (0.62) RIPK2KDRRIPK3RIPK1EGFR
SCHEMBL2593034 0.89 RIPK2 (0.56) RIPK2KDRRIPK3RIPK1EGFR
SCHEMBL2594950 0.88 RIPK2 (0.54) RIPK2KDRRIPK3RIPK1EGFR
SCHEMBL2595656 0.85 RIPK2 (0.62) RIPK2KDRRIPK3RIPK1EGFR
SCHEMBL12180631 0.84 RIPK2 (0.59) RIPK2KDRRIPK3RIPK1EGFR
SCHEMBL2594624 0.84 RIPK2 (0.66) RIPK2KDRRIPK3RIPK1EGFR
SCHEMBL12180643 0.84 RIPK2 (0.60) RIPK2KDRRIPK3RIPK1EGFR
SCHEMBL2596178 0.83 RIPK2 (0.57) RIPK2KDRRIPK3RIPK1EGFR
SCHEMBL2594962 0.82 RIPK2 (0.61) RIPK2KDRRIPK3RIPK1EGFR

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-2566477-B1 AMINO-QUINOLINES AS KINASE INHIBITORS GLAXOSMITHKLINE IP DEV LTD (GB) 2015-09-02 EP disclosed