SCHEMBL15439494

SCHEMBL15439494

CCC(=O)C(=NN(Cc1ccccc1)Cc1ccccc1)C(C)=NN(Cc1ccccc1)Cc1ccccc1

nearest known ligand 0.51

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
G6PC1 P35575 2/20 0.51
CA12 O43570 1/20 0.42
CA9 Q16790 1/20 0.42
LMNA P02545 1/20 0.41
NPC1 O15118 2/20 0.39
RAB9A P51151 2/20 0.39
CES2 O00748 1/20 0.39
CES1 P23141 1/20 0.39
RIPK1 Q13546 2/20 0.38
TSPO P30536 1/20 0.37
ALDH1A1 P00352 1/20 0.37
KMT2A Q03164 2/20 0.36
MEN1 O00255 1/20 0.36
TSHR P16473 1/20 0.36
MAPK1 P28482 1/20 0.36
CRHBP P24387 1/20 0.36
CRHR2 Q13324 1/20 0.36
MAPT P10636 1/20 0.36

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
SCHEMBL15439493 1.00 G6PC1 (0.51) G6PC1CA12CA9LMNANPC1
SCHEMBL15440325 0.89 G6PC1 (0.56) G6PC1CA12CA9LMNANPC1
SCHEMBL15440322 0.89 G6PC1 (0.56) G6PC1CA12CA9LMNANPC1
SCHEMBL15438594 0.86 G6PC1 (0.53) G6PC1CA12CA9LMNANPC1
SCHEMBL15438597 0.86 G6PC1 (0.53) G6PC1CA12CA9LMNANPC1
SCHEMBL15439585 0.84 NPC1 (0.41) G6PC1CA12CA9LMNANPC1
SCHEMBL15439586 0.84 NPC1 (0.41) G6PC1CA12CA9LMNANPC1
SCHEMBL14799732 0.83 G6PC1 (0.53) G6PC1CA12CA9LMNANPC1
SCHEMBL14799421 0.83 G6PC1 (0.53) G6PC1CA12CA9LMNANPC1
SCHEMBL15439850 0.81 LMNA (0.39) G6PC1CA12CA9LMNANPC1

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-9115231-B2 Polymers functionalized with protected hydrazone compounds containing an acyl group BRIDGESTONE CORPORATION (JP) 2015-08-25 US disclosed
US-20140031488-A1 Polymers Functionalized With Protected Hydrazone Compounds Containing An Acyl Group BRIDGESTONE CORPORATION (JP) 2014-01-30 US disclosed