SCHEMBL7101993

SCHEMBL7101993

CC(C)(C)OC(=O)N1CCC(N2CC(C)(C)c3ccc(NC(=O)c4cccnc4NCc4ccc(F)cc4)cc32)CC1.CC1(C)CN(C2CCNCC2)c2cc(NC(=O)c3cccnc3NCc3ccc(F)cc3)ccc21

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDR P35968 8/20 0.46
CIT O14578 1/20 0.46
MAP3K7 O43318 1/20 0.46
RIPK2 O43353 1/20 0.46
STK10 O94804 1/20 0.46
MAP4K4 O95819 1/20 0.46
ABL1 P00519 1/20 0.46
EGFR P00533 1/20 0.46
RAF1 P04049 1/20 0.46
LCK P06239 1/20 0.46
FYN P06241 1/20 0.46
CSF1R P07333 1/20 0.46
YES1 P07947 1/20 0.46
LYN P07948 1/20 0.46
RET P07949 1/20 0.46
HCK P08631 1/20 0.46
PDGFRB P09619 1/20 0.46
FGR P09769 1/20 0.46
KIT P10721 1/20 0.46
FGFR1 P11362 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
SCHEMBL6104801 0.97 KDR (0.47) KDRCITMAP3K7RIPK2STK10
SCHEMBL6105346 0.92 KDR (0.53) KDRCITMAP3K7RIPK2STK10
SCHEMBL6105677 0.86 KDR (0.54) KDRCITMAP3K7RIPK2STK10
SCHEMBL445693 0.85 KDR (0.63) KDRCITMAP3K7RIPK2STK10
SCHEMBL6105662 0.82 KDR (0.51) KDRCITMAP3K7RIPK2STK10
SCHEMBL6103947 0.82 KDR (0.53) KDRCITMAP3K7RIPK2STK10
SCHEMBL447574 0.81 KDR (0.51) KDRCITMAP3K7RIPK2STK10
SCHEMBL6105170 0.81 KDR (0.52) KDRCITMAP3K7RIPK2STK10
SCHEMBL450183 0.81 KDR (0.54) KDRCITMAP3K7RIPK2STK10
SCHEMBL427642 0.79 KDR (0.64) KDRCITMAP3K7RIPK2STK10

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-1358161-A2 N-PYRIDYL CARBOXAMIDE DERIVATIVES AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM Amgen Inc. (US) 2003-11-05 EP disclosed
WO-2002055501-A2 N-PYRIDYL CARBOXAMIDE DERIVATIVES AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM AMGEN INC (US) 2002-07-18 WO disclosed