SCHEMBL1012192

SCHEMBL1012192

COc1cc2ncnc(Sc3ccccc3N)c2cc1OC

nearest known ligand 0.57

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
EGFR P00533 7/20 0.57
KDR P35968 4/20 0.57
RET P07949 3/20 0.57
LCK P06239 2/20 0.57
KIF5B P33176 1/20 0.57
KDM1A O60341 6/20 0.54
FLT3 P36888 2/20 0.53
CSF1R P07333 4/20 0.49
PDGFRB P09619 1/20 0.48
PDGFRA P16234 1/20 0.48
KIT P10721 1/20 0.46

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
SCHEMBL1012315 0.90 EGFR (0.51) EGFRKDRRETLCKKIF5B
SCHEMBL4386131 0.83 EGFR (0.59) EGFRKDRRETLCKKIF5B
SCHEMBL1012180 0.78 KDR (0.73) EGFRKDRRETLCKKIF5B
SCHEMBL14478889 0.77 EGFR (0.58) EGFRKDRRETLCKKIF5B
SCHEMBL4375169 0.76 KDM1A (0.76) EGFRKDRRETLCKKIF5B
SCHEMBL2473728 0.76 KIT (0.61) EGFRKDRRETLCKKIF5B
SCHEMBL18158551 0.74 KDM1A (0.62) EGFRKDRRETLCKKIF5B
SCHEMBL1015599 0.74 TRPA1 (0.61) EGFRKDRRETLCKKIF5B
O-Tolylamine SCHEMBL27484550 0.74 HPGD (0.50) EGFRKDRRETLCKCSF1R
SCHEMBL7209616 0.73 KDR (1.00) EGFRKDRRETLCKKIF5B

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-2268623-A1 QUINAZOLINE DERIVATIVES AS RAF KINASE MODULATORS AND METHODS OF USE THEREOF Ambit Biosciences Corporation (US) 2011-01-05 EP disclosed
WO-2009117080-A1 QUINAZOLINE DERIVATIVES AS RAF KINASE MODULATORS AND METHODS OF USE THEREOF AMBIT BIOSCIENCES CORPORATON (US) 2009-09-24 WO disclosed