SCHEMBL3735342

SCHEMBL3735342

Cc1c[nH]c(-c2cc[c]cc2)n1

nearest known ligand 0.33

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.33
MAPT P10636 1/20 0.33
MAPK1 P28482 1/20 0.32
NPC1 O15118 1/20 0.30
PKM P14618 1/20 0.30
RAB9A P51151 1/20 0.30

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
SCHEMBL28201939 0.85 GAA (0.44) GAAMAPTNPC1PKMRAB9A
SCHEMBL27985279 0.85 MAPK1 (0.40) GAAMAPTMAPK1NPC1PKM
SCHEMBL49612 0.79 GAA (0.52) GAAMAPTNPC1RAB9A
SCHEMBL3665728 0.78 GAA (0.33) GAAMAPTNPC1PKMRAB9A
Phosphine SCHEMBL28142196 0.78 GAA (0.50) GAAMAPTNPC1RAB9A
SCHEMBL2652520 0.77
SCHEMBL10554989 0.76 GAA (0.44) GAAMAPTNPC1PKMRAB9A
SCHEMBL3635215 0.76 NPC1 (0.44) GAAMAPTMAPK1NPC1PKM
SCHEMBL797826 0.76 TNKS (0.40) GAAMAPTMAPK1NPC1RAB9A
SCHEMBL28279252 0.76 ALDH1A1 (0.46) GAAMAPTNPC1PKMRAB9A

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
WO-1999051590-A1 SUBSTITUTED INDOLINONES AS KINASE INHIBITORS BOEHRINGER INGELHEIM PHARMA KG (DE) 1999-10-14 WO claimed
EP-2155740-A1 HETARYLANILINES AS MODULATORS FOR AMYLOID BETA F. Hoffmann-Roche AG (CH) 2010-02-24 EP disclosed
WO-2008138753-A1 HETARYLANILINES AS MODULATORS FOR AMYLOID BETA F. HOFFMANN-LA ROCHE AG (CH) 2008-11-20 WO disclosed