SCHEMBL8480872

SCHEMBL8480872

Fc1ccc(C=NNc2nc(Cl)nc3[nH]cnc23)cc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 12/20 0.53
NPC1 O15118 10/20 0.53
PKM P14618 4/20 0.53
KMT2A Q03164 2/20 0.44
GSK3A P49840 1/20 0.44
GSK3B P49841 1/20 0.44
MAPT P10636 5/20 0.43
HTT P42858 1/20 0.43
MAPK1 P28482 1/20 0.42
GAA P10253 5/20 0.41
SMN1; SMN2 Q16637 5/20 0.40
KDM4E B2RXH2 4/20 0.39
LMNA P02545 2/20 0.39
ATM Q13315 1/20 0.39
GLA P06280 1/20 0.38
POLB P06746 1/20 0.38
ALPL P05186 1/20 0.38
ALPI P09923 1/20 0.38
ALPG P10696 1/20 0.38
NR0B1 P51843 1/20 0.38

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
SCHEMBL8481591 0.90 NPC1 (0.55) RAB9ANPC1PKMKMT2AMAPT
SCHEMBL8484763 0.88 RAB9A (0.53) RAB9ANPC1PKMKMT2AMAPT
SCHEMBL8484610 0.87 MAPT (0.51) RAB9ANPC1PKMKMT2AMAPT
SCHEMBL8484614 0.87 MAPT (0.51) RAB9ANPC1PKMKMT2AMAPT
SCHEMBL8487763 0.84 NOX3 (0.51) RAB9ANPC1PKMKMT2AMAPT
SCHEMBL8480596 0.84 MAPT (0.56) RAB9ANPC1PKMKMT2AMAPT
SCHEMBL8484425 0.82 MAPT (0.48) RAB9ANPC1PKMKMT2AMAPT
SCHEMBL3468490 0.81 GSK3A (0.53) RAB9ANPC1PKMKMT2AGSK3A
SCHEMBL3468495 0.81 GSK3A (0.53) RAB9ANPC1PKMKMT2AGSK3A
SCHEMBL31576451 0.79 NPC1 (0.48) RAB9ANPC1PKMKMT2AMAPT

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
US-5990118-A NOVEL PURINE COMPOUNDS AND TRIAZOLOPURINE COMPOUNDS WHICH INHIBIT XANTHINE OXIDASE; REMEDIES FOR HYPERURICEMIA, AND AS PREVENTIVE AND THERAPEUTIC AGENTS FOR GOUT YAMASA CORPORATION (JP) 1999-11-23 US disclosed
EP-0811624-A1 PURINE COMPOUNDS AND XANTHINE OXIDASE INHIBITORS YAMASA CORPORATION (JP) 1997-12-10 EP disclosed