SCHEMBL8913763

SCHEMBL8913763

C[Si](C)(C)O[Si](C)(C)CCCCCOc1ccc(C(=O)Oc2ccc(C#N)cc2)cc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 5/20 0.49
NPC1 O15118 3/20 0.49
NFKB1 P19838 3/20 0.49
NFKB2 Q00653 3/20 0.49
RELA Q04206 3/20 0.49
SMN1; SMN2 Q16637 2/20 0.49
MAPT P10636 4/20 0.49
ALDH1A1 P00352 2/20 0.49
CYP1A2 P05177 3/20 0.47
CYP2D6 P10635 2/20 0.47
CYP2C9 P11712 2/20 0.47
CYP2C19 P33261 2/20 0.47
CYP3A4 P08684 1/20 0.47
KMT2A Q03164 2/20 0.44
POLB P06746 2/20 0.43
MGLL Q99685 2/20 0.43
HDAC1 Q13547 1/20 0.43
HDAC2 Q92769 1/20 0.43
TP53 P04637 1/20 0.43
HIF1A Q16665 1/20 0.43

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
SCHEMBL8919726 1.00 LMNA (0.49) LMNANPC1NFKB1NFKB2RELA
SCHEMBL8912381 0.95 MAPT (0.51) LMNANPC1NFKB1NFKB2RELA
SCHEMBL13610324 0.91 LMNA (0.49) LMNANPC1NFKB1NFKB2RELA
SCHEMBL13205316 0.90 MAPT (0.50) LMNANPC1NFKB1NFKB2RELA
SCHEMBL8912149 0.89 F2 (0.44) LMNANPC1NFKB1NFKB2RELA
SCHEMBL8915721 0.88 MAPT (0.53) LMNANPC1NFKB1NFKB2RELA
SCHEMBL8913234 0.88 MAPT (0.53) LMNANPC1NFKB1NFKB2RELA
SCHEMBL9685119 0.88 LMNA (0.63) LMNANPC1NFKB1NFKB2RELA
SCHEMBL9305454 0.88 LMNA (0.63) LMNANPC1NFKB1NFKB2RELA
SCHEMBL8913530 0.87 LMNA (0.65) LMNANPC1NFKB1NFKB2RELA

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-RE35462-E Silylated benzoic acid derivatives CONSORTIUM FUR ELEKOCHEMISCHE IND. GMBH (DE) 1997-02-25 US disclosed
US-5106530-A Liquid crystals Consortium Fur Elektrochemische Ind. (DE) 1992-04-21 US disclosed