SCHEMBL15438747

SCHEMBL15438747

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

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ATM Q13315 1/20 0.43
TP53 P04637 1/20 0.42
ALDH1A1 P00352 6/20 0.42
MAPT P10636 6/20 0.42
SMN1; SMN2 Q16637 5/20 0.42
RAB9A P51151 4/20 0.42
LMNA P02545 1/20 0.42
KDM4E B2RXH2 2/20 0.40
CES1 P23141 2/20 0.39
CES2 O00748 1/20 0.39
NPC1 O15118 2/20 0.38
KMT2A Q03164 3/20 0.37
HPGD P15428 2/20 0.36
NPSR1 Q6W5P4 1/20 0.35
GAA P10253 2/20 0.35
HTT P42858 1/20 0.35
MEN1 O00255 1/20 0.35
CYP3A4 P08684 1/20 0.35
ALOX15 P16050 1/20 0.35
MAPK1 P28482 1/20 0.35

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
SCHEMBL15438748 1.00 ATM (0.43) ATMTP53ALDH1A1MAPTSMN1; SMN2
SCHEMBL15440080 0.87 ALDH1A1 (0.44) ATMTP53ALDH1A1MAPTSMN1; SMN2
SCHEMBL15440081 0.87 ALDH1A1 (0.44) ATMTP53ALDH1A1MAPTSMN1; SMN2
SCHEMBL15439632 0.87 KMT2A (0.46) TP53ALDH1A1MAPTSMN1; SMN2RAB9A
SCHEMBL15439634 0.87 KMT2A (0.46) TP53ALDH1A1MAPTSMN1; SMN2RAB9A
SCHEMBL15438549 0.84 CYP1A2 (0.41) ATMTP53ALDH1A1MAPTSMN1; SMN2
SCHEMBL15438548 0.84 CYP1A2 (0.41) ATMTP53ALDH1A1MAPTSMN1; SMN2
SCHEMBL15439833 0.84 RAB9A (0.45) ATMTP53ALDH1A1MAPTSMN1; SMN2
SCHEMBL15439831 0.84 RAB9A (0.45) ATMTP53ALDH1A1MAPTSMN1; SMN2
SCHEMBL15439738 0.83 G6PC1 (0.40) ATMTP53ALDH1A1MAPTSMN1; 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 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