SCHEMBL20530358

SCHEMBL20530358

COCc1ccc(-c2ccc3nnn(Cc4cccc5cccnc45)c3n2)cc1F

nearest known ligand 0.41

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MET P08581 17/20 0.41
PSEN1 P49768 1/20 0.40
PSEN2 P49810 1/20 0.40
KCNH2 Q12809 1/20 0.40
APH1B Q8WW43 1/20 0.40
NCSTN Q92542 1/20 0.40
APH1A Q96BI3 1/20 0.40
PSENEN Q9NZ42 1/20 0.40
KDM4E B2RXH2 1/20 0.34
NPC1 O15118 1/20 0.34
ALOX12 P18054 1/20 0.34
HTT P42858 1/20 0.34
RAB9A P51151 1/20 0.34
NPSR1 Q6W5P4 1/20 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
SCHEMBL20530338 0.88 MET (0.42) METPSEN1PSEN2KCNH2APH1B
SCHEMBL1330043 0.86 MET (0.54) MET
SCHEMBL20530330 0.83 MET (0.39) METPSEN1PSEN2KCNH2APH1B
SCHEMBL20530289 0.83 MET (0.43) METPSEN1PSEN2KCNH2APH1B
SCHEMBL20530302 0.83 MET (0.51) METKDM4ENPC1HTTRAB9A
SCHEMBL20530343 0.82 BRAF (0.41) METKCNH2NPC1RAB9ANPSR1
SCHEMBL20530371 0.81 MET (0.43) MET
SCHEMBL20530349 0.81 MET (0.48) METKCNH2
SCHEMBL20530356 0.81 GRIN2B (0.39) METKDM4E
SCHEMBL20530361 0.81 MET (0.40) METKCNH2

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-2571878-B1 NOVEL 3,5-DISUBSTITUED-3H-IMIDAZO[4,5-B]PYRIDINE AND 3,5- DISUBSTITUED -3H-[1,2,3]TRIAZOLO[4,5-B]PYRIDINE COMPOUNDS AS MODULATORS OF PROTEIN KINASES INCOZEN THERAPEUTICS PVT LTD (IN) 2018-10-17 EP claimed