SCHEMBL15775366

SCHEMBL15775366

Cc1ccc(C2=NC(=O)c3cccc(N)c3C2)cc1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 4/20 0.38
NPC1 O15118 3/20 0.38
MAPT P10636 3/20 0.38
ALDH1A1 P00352 2/20 0.38
KDM4E B2RXH2 2/20 0.38
SMN1; SMN2 Q16637 2/20 0.38
PKM P14618 2/20 0.38
ADORA2A P29274 1/20 0.38
PARP1 P09874 3/20 0.36
CD274 Q9NZQ7 1/20 0.34
RXFP1 Q9HBX9 1/20 0.33
KDR P35968 2/20 0.32
TYR P14679 1/20 0.32
HPGDS O60760 1/20 0.32
TP53 P04637 1/20 0.32
TSHR P16473 1/20 0.32
MAPK1 P28482 1/20 0.32
AGTR1 P30556 1/20 0.32
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32

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
SCHEMBL15775665 0.87 ALDH1A1 (0.40) RAB9ANPC1MAPTALDH1A1KDM4E
SCHEMBL15775398 0.85 RAB9A (0.40) RAB9ANPC1MAPTALDH1A1KDM4E
SCHEMBL15775407 0.85 CCNE2 (0.44) RAB9ANPC1MAPTALDH1A1KDM4E
Hydrochloric Acid SCHEMBL15775431 0.84 NOTUM (0.38) RAB9ANPC1MAPTKDM4ESMN1; SMN2
Bromide SCHEMBL15775833 0.84 RXFP1 (0.34) RAB9ANPC1MAPTALDH1A1KDM4E
Bromide SCHEMBL15775323 0.84 TYR (0.41) RAB9ANPC1MAPTALDH1A1KDM4E
SCHEMBL15775290 0.83 RAB9A (0.38) RAB9ANPC1MAPTALDH1A1KDM4E
SCHEMBL15775980 0.82 LAP3 (0.41) PARP1
Bromide SCHEMBL15775523 0.81 LAP3 (0.40) PARP1
SCHEMBL15775204 0.81 CYP19A1 (0.41) RAB9ANPC1MAPTALDH1A1KDM4E

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
WO-2014087165-A1 TANKYRASE INHIBITORS UNIVERSITY OF BATH (GB) 2014-06-12 WO disclosed