SCHEMBL16101437

SCHEMBL16101437

COc1ccccc1/N=C/c1ccc2ncn(C)c2c1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.45
POLB P06746 1/20 0.45
MAPT P10636 5/20 0.42
NPC1 O15118 4/20 0.42
SMN1; SMN2 Q16637 2/20 0.42
RAB9A P51151 1/20 0.42
TP53 P04637 2/20 0.41
GAA P10253 2/20 0.41
KDM4E B2RXH2 3/20 0.40
HSD17B10 Q99714 2/20 0.40
CASP1 P29466 1/20 0.40
RXFP1 Q9HBX9 1/20 0.40
NOTUM Q6P988 1/20 0.39
CLK1 P49759 2/20 0.38
DYRK1A Q13627 2/20 0.38
CLK4 Q9HAZ1 2/20 0.38
DYRK1B Q9Y463 2/20 0.38
DPP4 P27487 1/20 0.38
THRB P10828 1/20 0.37
PKM P14618 1/20 0.37

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
SCHEMBL16101441 1.00 ALDH1A1 (0.45) ALDH1A1POLBMAPTNPC1SMN1; SMN2
SCHEMBL17499687 0.88 NOTUM (0.38) ALDH1A1POLBMAPTNPC1SMN1; SMN2
SCHEMBL17499683 0.88 NOTUM (0.38) ALDH1A1POLBMAPTNPC1SMN1; SMN2
SCHEMBL16103156 0.80 MAPT (0.42) ALDH1A1POLBMAPTNPC1SMN1; SMN2
SCHEMBL16102212 0.80 CLK1 (0.41) ALDH1A1POLBMAPTNPC1SMN1; SMN2
SCHEMBL16103153 0.80 MAPT (0.42) ALDH1A1POLBMAPTNPC1SMN1; SMN2
SCHEMBL16102217 0.78 SHBG (0.43) ALDH1A1POLBMAPTNPC1SMN1; SMN2
SCHEMBL16101590 0.77 MAPT (0.43) ALDH1A1MAPTNPC1SMN1; SMN2RAB9A
SCHEMBL16101588 0.77 MAPT (0.43) ALDH1A1MAPTNPC1SMN1; SMN2RAB9A
SCHEMBL16097073 0.74 ALDH1A1 (0.45) ALDH1A1POLBMAPTNPC1SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2969593-B1 POLYMERS FUNCTIONALIZED WITH HETEROCYCLIC IMINES BRIDGESTONE CORP (JP) 2020-11-04 EP disclosed
US-9850328-B2 Polymers functionalized with heterocyclic imines BRIDGESTONE CORPORATION (JP) 2017-12-26 US disclosed
US-20160039958-A1 Polymers Functionalized With Heterocyclic Imines BRIDGESTONE CORPORATION (JP) 2016-02-11 US disclosed
EP-2969593-A1 POLYMERS FUNCTIONALIZED WITH HETEROCYCLIC IMINES Bridgestone Corporation (JP) 2016-01-20 EP disclosed
WO-2014149931-A1 POLYMERS FUNCTIONALIZED WITH HETEROCYCLIC IMINES BRIDGESTONE CORPORATION (JP) 2014-09-25 WO disclosed