SCHEMBL6380340

SCHEMBL6380340

COc1ccc2c(Nc3ccc(Cl)cc3F)c(C#N)cnc2c1N

nearest known ligand 0.69

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
SRC P12931 16/20 0.69
EGFR P00533 4/20 0.69
ERBB2 P04626 3/20 0.69
ABL1 P00519 1/20 0.55
BCR P11274 1/20 0.55
CSF1R P07333 1/20 0.47
NUDT1 P36639 1/20 0.47

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
SCHEMBL6387094 0.89 SRC (0.70) SRCEGFRERBB2ABL1BCR
SCHEMBL6382448 0.86 SRC (0.71) SRCEGFRERBB2ABL1BCR
SCHEMBL6386277 0.86 SRC (0.66) SRCEGFRERBB2ABL1BCR
SCHEMBL6383067 0.84 EGFR (0.69) SRCEGFRERBB2
SCHEMBL6380454 0.84 SRC (0.74) SRCEGFRERBB2ABL1BCR
SCHEMBL6379607 0.84 SRC (0.68) SRCEGFRERBB2ABL1BCR
SCHEMBL6380332 0.82 SRC (0.85) SRCEGFRERBB2ABL1BCR
SCHEMBL6384845 0.82 SRC (0.61) SRCEGFRERBB2ABL1BCR
SCHEMBL1894458 0.82 SRC (1.00) SRCEGFRERBB2ABL1BCR
SCHEMBL6997074 0.81 SRC (0.56) SRCEGFRERBB2ABL1BCR

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
EP-1263503-B1 USE OF CYANOQUINOLINES FOR TREATING OR INHIBITING COLONIC POLYPS WYETH CORP (US) 2005-11-02 EP claimed
EP-0973746-B1 SUBSTITUTED 3-CYANO QUINOLINES WYETH CORP (US) 2003-09-24 EP claimed