SCHEMBL28136263

SCHEMBL28136263

Nc1cnc(-c2c(F)cccc2F)nc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.42
KMT2A Q03164 2/20 0.42
ALOX5AP P20292 1/20 0.40
FEN1 P39748 1/20 0.40
HRH4 Q9H3N8 1/20 0.38
TYK2 P29597 1/20 0.38
BACE1 P56817 1/20 0.37
NPC1 O15118 4/20 0.35
RAB9A P51151 4/20 0.35
SMN1; SMN2 Q16637 2/20 0.35
KDM4E B2RXH2 2/20 0.35
ALDH1A1 P00352 2/20 0.35
MAPT P10636 2/20 0.35
TP53 P04637 1/20 0.35
HPGD P15428 1/20 0.35
HSD17B10 Q99714 1/20 0.35
TTR P02766 1/20 0.35
LMNA P02545 1/20 0.34
BCL6 P41182 1/20 0.34
NOS3 P29474 2/20 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
SCHEMBL12277332 0.80 PTGES (0.40) MEN1KMT2AALOX5APFEN1TYK2
SCHEMBL20654332 0.80 L3MBTL1 (0.43) TYK2NPC1RAB9ASMN1; SMN2ALDH1A1
SCHEMBL2409693 0.78 MEN1 (0.47) MEN1KMT2AALOX5APFEN1BACE1
SCHEMBL12578987 0.78 RAB9A (0.41) HRH4TYK2NPC1RAB9ASMN1; SMN2
SCHEMBL28300766 0.78 TYK2 (0.37) MEN1KMT2AALOX5APFEN1HRH4
SCHEMBL20654333 0.77 NPC1 (0.59) MEN1KMT2ANPC1RAB9ASMN1; SMN2
SCHEMBL12452238 0.74 NPC1 (0.39) ALOX5APFEN1HRH4TYK2BACE1
SCHEMBL9566587 0.73 HRH4 (0.57) HRH4BACE1NPC1RAB9ASMN1; SMN2
SCHEMBL4389561 0.72 NPC1 (0.58) MEN1KMT2AALOX5APFEN1NPC1
SCHEMBL8372471 0.72 TTR (0.41) HRH4TYK2BACE1NPC1RAB9A

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
CN-104334546-B Novel ring-substituted N-pyridyl amides as kinase inhibitors 诺华股份有限公司 2017-05-03 CN disclosed