SCHEMBL13618576

SCHEMBL13618576

Bc1ccc(Nc2nc3cc(Oc4ccnc(CN)c4)ccc3n2C)cc1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAF1 P04049 11/20 0.57
BRAF P15056 19/20 0.54
LCK P06239 2/20 0.49
FYN P06241 2/20 0.49
PDGFRB P09619 2/20 0.49
KIT P10721 2/20 0.49
SRC P12931 2/20 0.49
FLT1 P17948 2/20 0.49
FLT4 P35916 2/20 0.49
KDR P35968 2/20 0.49
STK25 O00506 1/20 0.49
CIT O14578 1/20 0.49
EPHB6 O15197 1/20 0.49
MAP3K7 O43318 1/20 0.49
RIPK2 O43353 1/20 0.49
PAK3 O75914 1/20 0.49
STK10 O94804 1/20 0.49
MAP4K4 O95819 1/20 0.49
ABL1 P00519 1/20 0.49
CSF1R P07333 1/20 0.49

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
SCHEMBL2893834 0.90 RAF1 (0.71) RAF1BRAFLCKFYNPDGFRB
SCHEMBL13618571 0.90 BRAF (0.55) RAF1BRAFLCKFYNPDGFRB
SCHEMBL2895281 0.81 BRAF (0.67) RAF1BRAFKDR
SCHEMBL13838889 0.80 RAF1 (0.66) RAF1BRAFKDR
SCHEMBL13838887 0.80 RAF1 (0.57) RAF1BRAFLCKFYNPDGFRB
SCHEMBL13211150 0.80 RAF1 (0.57) RAF1BRAFLCKFYNPDGFRB
SCHEMBL2893951 0.80 P2RX3 (0.63) RAF1BRAFKDR
SCHEMBL2901751 0.80 RAF1 (0.71) RAF1BRAFKDR
SCHEMBL13618558 0.79 BRAF (0.70) RAF1BRAFLCKFYNPDGFRB
SCHEMBL2886102 0.79 RAF1 (0.64) RAF1BRAFLCKFYNPDGFRB

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-1499311-B1 SUBSTITUTED BENZAZOLES AND USE THEREOF AS RAF KINASE INHIBITORS NOVARTIS VACCINES & DIAGNOSTIC (US) 2009-11-04 EP disclosed