SCHEMBL17241848

SCHEMBL17241848

NC(=O)c1ccnc(Oc2ccc(N)cc2F)n1

nearest known ligand 0.43

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ ALOX5AP P20292 3/20 0.43
▸ FEN1 P39748 3/20 0.43
▸ MET P08581 8/20 0.38
▸ MAPK14 Q16539 1/20 0.37
▸ RET P07949 1/20 0.35
▸ KIT P10721 1/20 0.35
▸ PDGFRA P16234 1/20 0.35
▸ KDR P35968 1/20 0.35
▸ FLT3 P36888 1/20 0.35
▸ SCN9A Q15858 6/20 0.34

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
SCHEMBL17242344 0.84 ALDH1A1 (0.42) ALOX5APFEN1SCN9A
SCHEMBL17242219 0.84 ALOX5AP (0.39) ALOX5APFEN1SCN9A
SCHEMBL1137174 0.80 MET (0.48) METKDR
SCHEMBL26585989 0.78 ALOX5AP (0.50) ALOX5APFEN1MAPK14
SCHEMBL17242347 0.76 SCN9A (0.44) ALOX5APFEN1SCN9A
SCHEMBL3660606 0.74 MET (0.58) METRETKITPDGFRAKDR
SCHEMBL15084524 0.73 MET (0.44) METRETKITPDGFRAKDR
SCHEMBL14290046 0.72 MET (0.46) METKDR
SCHEMBL27865966 0.71 NPC1 (0.41) ALOX5APFEN1SCN9A
SCHEMBL17242062 0.71 ROCK2 (0.54) —

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
CN-105085482-A Substituted piperazine compound, and usage method and application thereof GUANGDONG HEC PHARMACEUTICAL 2015-11-25 — — CN disclosed
WO-2015169180-A1 SUBSTITUTED PIPERAZINE COMPOUNDS AND METHODS AND USE THEREOF SUNSHINE LAKE PHARMA CO., LTD. (CN) 2015-11-12 — — WO disclosed
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