SCHEMBL3459484

SCHEMBL3459484

Cc1cc2nc(-c3[nH]nc4c3CCN(S(=O)(=O)c3ccccc3Cl)C4)[nH]c2cc1C

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 1/20 0.39
RAB9A P51151 1/20 0.39
ATM Q13315 1/20 0.39
ERAP1 Q9NZ08 1/20 0.39
GUSB P08236 1/20 0.38
TRPV1 Q8NER1 1/20 0.37
METAP2 P50579 1/20 0.36
METAP1 P53582 1/20 0.36
CBFB Q13951 1/20 0.36
CHRM4 P08173 2/20 0.36
PDGFRB P09619 1/20 0.36
FGFR1 P11362 1/20 0.36
KDR P35968 1/20 0.36
MAPT P10636 4/20 0.35
KMT2A Q03164 3/20 0.35
LMNA P02545 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
HTR6 P50406 2/20 0.35
AMY1A P0DUB6 2/20 0.35
ADORA3 P0DMS8 1/20 0.35

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
SCHEMBL3455272 0.93 HTR6 (0.43) NPC1RAB9AATMERAP1GUSB
SCHEMBL14031947 0.92 NPC1 (0.40) NPC1RAB9AATMERAP1METAP2
SCHEMBL3458009 0.87 NPC1 (0.39) NPC1RAB9AATMERAP1METAP2
SCHEMBL3457087 0.86 MAPT (0.43) NPC1RAB9AATMERAP1GUSB
SCHEMBL3461819 0.85 MAPT (0.43) NPC1RAB9AATMERAP1GUSB
SCHEMBL3458954 0.84 CD4 (0.43) NPC1RAB9AATMERAP1MAPT
SCHEMBL3455109 0.83 NPC1 (0.40) NPC1RAB9AATMERAP1METAP2
SCHEMBL3461277 0.83 BRD4 (0.41) NPC1RAB9AATMERAP1METAP2
SCHEMBL3457131 0.83 GRM5 (0.38) NPC1RAB9AATMERAP1METAP2
SCHEMBL3463347 0.82 MCOLN3 (0.44) NPC1RAB9AATMERAP1MAPT

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2251340-A1 Substituted tetrahydro-1h-pyrazolo[3,4-c] pyridines, compositions containing same and use thereof Aventis Pharma S.A. (FR) 2010-11-17 EP disclosed
US-7435820-B2 Substituted tetrahydro-1H-pyrazolo [3,4-c]pyridines compositions comprising them, and use AVENTIS PHARMA S.A. (FR) 2008-10-14 US disclosed
US-7435820-B2 Substituted tetrahydro-1H-pyrazolo [3,4-c]pyridines compositions comprising them, and use AVENTIS PHARMA S.A. (FR) 2008-10-14 US disclosed