SCHEMBL15440398

SCHEMBL15440398

CC/C(=N\N(c1ccccc1)[Si](C)(C)C)C(C)=O

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.39
TSHR P16473 3/20 0.39
GLA P06280 1/20 0.39
TP53 P04637 2/20 0.35
MAPT P10636 2/20 0.34
MTNR1A P48039 1/20 0.34
MTNR1B P49286 1/20 0.34
SMN1; SMN2 Q16637 3/20 0.34
RAB9A P51151 2/20 0.34
LMNA P02545 1/20 0.34
KMT2A Q03164 4/20 0.33
MEN1 O00255 3/20 0.33
POLB P06746 1/20 0.33
HTT P42858 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
MAPK1 P28482 1/20 0.33
CYP3A4 P08684 1/20 0.33
CYP2C9 P11712 1/20 0.33
CYP2C19 P33261 1/20 0.33
CES2 O00748 1/20 0.33

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
SCHEMBL15440400 1.00 ALDH1A1 (0.39) ALDH1A1TSHRGLATP53MAPT
SCHEMBL14799594 0.89 ALDH1A1 (0.36) ALDH1A1TSHRGLATP53MAPT
SCHEMBL14799591 0.89 ALDH1A1 (0.36) ALDH1A1TSHRGLATP53MAPT
SCHEMBL15439783 0.88 TP53 (0.43) ALDH1A1TSHRGLATP53MAPT
SCHEMBL15439781 0.88 TP53 (0.43) ALDH1A1TSHRGLATP53MAPT
SCHEMBL15440016 0.88 CES2 (0.40) ALDH1A1TSHRGLATP53MAPT
SCHEMBL15440013 0.88 CES2 (0.40) ALDH1A1TSHRGLATP53MAPT
SCHEMBL14799150 0.86 ALDH1A1 (0.33) ALDH1A1TSHRGLAKMT2AMEN1
SCHEMBL14799148 0.86 ALDH1A1 (0.33) ALDH1A1TSHRGLAKMT2AMEN1
SCHEMBL14799678 0.82 ALDH1A1 (0.31) ALDH1A1TSHRGLAMAPK1

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