SCHEMBL896937

SCHEMBL896937

C=CN(CCNCCC[Si](O)(O)O)Cc1ccccc1

nearest known ligand 0.43

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.43
KCNH2 Q12809 3/20 0.41
REN P00797 2/20 0.41
L3MBTL1 Q9Y468 1/20 0.39
BACE1 P56817 1/20 0.37
SIGMAR1 Q99720 2/20 0.37
KDM4E B2RXH2 1/20 0.35
NPC1 O15118 1/20 0.35
ALDH1A1 P00352 1/20 0.35
RAB9A P51151 1/20 0.35
CHRM2 P08172 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
SCHEMBL145173 0.84 ALDH1A1 (0.40) GAAKCNH2RENSIGMAR1ALDH1A1
Hydrochloric Acid SCHEMBL525155 0.83 ALDH1A1 (0.40) GAAKCNH2RENSIGMAR1ALDH1A1
SCHEMBL959977 0.83 KCNH2 (0.39) GAAKCNH2RENSIGMAR1ALDH1A1
Hydrochloric Acid SCHEMBL5894235 0.83 ALDH1A1 (0.40) GAAKCNH2RENSIGMAR1ALDH1A1
Hydrochloric Acid SCHEMBL9064046 0.82 NPSR1 (0.39) GAAKCNH2RENSIGMAR1ALDH1A1
SCHEMBL10537188 0.81 KCNH2 (0.43) GAAKCNH2RENBACE1SIGMAR1
SCHEMBL5171733 0.81 KCNH2 (0.37) GAAKCNH2RENSIGMAR1ALDH1A1
SCHEMBL22609166 0.80 KCNH2 (0.36) GAAKCNH2RENSIGMAR1ALDH1A1
Hydrochloric Acid SCHEMBL2678846 0.80 KCNH2 (0.36) GAAKCNH2RENSIGMAR1ALDH1A1
SCHEMBL7946214 0.80 KCNH2 (0.42) GAAKCNH2RENBACE1SIGMAR1

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-20120082791-A1 Coating Composition Amenable to Elastomeric Substrates LIVERSAGE ROBERT RICHARD (US) 2012-04-05 US claimed
US-20120082791-A1 Coating Composition Amenable to Elastomeric Substrates LIVERSAGE ROBERT RICHARD (US) 2012-04-05 US disclosed