SCHEMBL15439754

SCHEMBL15439754

CCC(=O)C/C(=N\N(C)C)c1ccccc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.48
MAPT P10636 5/20 0.48
SMN1; SMN2 Q16637 4/20 0.48
RAB9A P51151 2/20 0.48
LMNA P02545 1/20 0.48
ATM Q13315 1/20 0.47
TP53 P04637 1/20 0.45
KDM4E B2RXH2 3/20 0.43
CES1 P23141 2/20 0.42
CES2 O00748 1/20 0.42
KMT2A Q03164 4/20 0.39
HPGD P15428 2/20 0.38
MEN1 O00255 1/20 0.38
CYP3A4 P08684 1/20 0.38
ALOX15 P16050 1/20 0.38
MAPK1 P28482 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
HSP90AA1 P07900 1/20 0.38
HSP90AB1 P08238 1/20 0.38
NPSR1 Q6W5P4 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
SCHEMBL15439756 1.00 ALDH1A1 (0.48) ALDH1A1MAPTSMN1; SMN2RAB9ALMNA
SCHEMBL15439612 0.85 KMT2A (0.50) ALDH1A1MAPTSMN1; SMN2RAB9ALMNA
SCHEMBL15439610 0.85 KMT2A (0.50) ALDH1A1MAPTSMN1; SMN2RAB9ALMNA
SCHEMBL15440080 0.84 ALDH1A1 (0.44) ALDH1A1MAPTSMN1; SMN2RAB9ALMNA
SCHEMBL15440575 0.84 ALDH1A1 (0.44) ALDH1A1MAPTSMN1; SMN2RAB9ALMNA
SCHEMBL15440081 0.84 ALDH1A1 (0.44) ALDH1A1MAPTSMN1; SMN2RAB9ALMNA
SCHEMBL15439653 0.83 RAB9A (0.44) ALDH1A1MAPTSMN1; SMN2RAB9ALMNA
SCHEMBL15439656 0.83 RAB9A (0.44) ALDH1A1MAPTSMN1; SMN2RAB9ALMNA
SCHEMBL15440214 0.83 CYP1A2 (0.44) ALDH1A1MAPTSMN1; SMN2RAB9ALMNA
SCHEMBL15440215 0.83 CYP1A2 (0.44) ALDH1A1MAPTSMN1; SMN2RAB9ALMNA

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