SCHEMBL17488052

SCHEMBL17488052

CCn1c(NCc2ccc(Oc3ncc(C(F)(F)F)cn3)cc2F)nc2ccc(Nc3cc(C(F)(F)F)n(C)n3)cc21

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BRAF P15056 8/20 0.33
KDR P35968 6/20 0.33
RAF1 P04049 2/20 0.33
TP53 P04637 2/20 0.33
MCHR1 Q99705 1/20 0.32
GAA P10253 1/20 0.32
MAPT P10636 1/20 0.32
LCK P06239 2/20 0.32
TEK Q02763 2/20 0.32
LMNA P02545 1/20 0.32
ALOX5AP P20292 2/20 0.32
SCD O00767 1/20 0.31
JAK3 P52333 1/20 0.31
STK25 O00506 1/20 0.31
CIT O14578 1/20 0.31
EPHB6 O15197 1/20 0.31
MAP3K7 O43318 1/20 0.31
RIPK2 O43353 1/20 0.31
PAK3 O75914 1/20 0.31
STK10 O94804 1/20 0.31

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
SCHEMBL17488049 0.94 MAPT (0.34) BRAFKDRRAF1TP53GAA
SCHEMBL17488319 0.90 TP53 (0.39) BRAFKDRRAF1TP53MCHR1
SCHEMBL18965883 0.86 KDR (0.35) BRAFKDRRAF1TP53MCHR1
SCHEMBL18965823 0.86 NTRK1 (0.46) BRAFKDRRAF1JAK3NTRK1
SCHEMBL18965884 0.84 LMNA (0.39) TP53GAAMAPTLMNASCD
SCHEMBL17488323 0.83 MCHR1 (0.40) BRAFKDRRAF1TP53MCHR1
SCHEMBL17488247 0.83 LMNA (0.38) BRAFKDRTP53GAAMAPT
SCHEMBL17488050 0.82 TP53 (0.40) BRAFKDRRAF1TP53MCHR1
SCHEMBL17488231 0.81 SCN9A (0.34) KDRTP53MCHR1GAAMAPT
SCHEMBL17488053 0.80 MCHR1 (0.40) BRAFKDRRAF1MCHR1LCK

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
WO-2016016421-A1 2-AMINO-BENZIMIDAZOLE DERIVATIVES AND THEIR USE AS 5-LIPOXYGENASE AND/OR PROSTAGLANDIN E SYNTHASE INHIBITORS INSTITUT PASTEUR KOREA (KR) 2016-02-04 WO disclosed