SCHEMBL8912149

SCHEMBL8912149

C[Si](C)(C)O[Si](C)(C)CCCCCc1ccc(C(=O)Oc2ccc(C#N)cc2)cc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
F2 P00734 1/20 0.44
MGLL Q99685 2/20 0.41
ALDH1A1 P00352 2/20 0.41
CYP1A2 P05177 1/20 0.41
CYP2D6 P10635 1/20 0.41
HIF1A Q16665 1/20 0.41
RAB9A P51151 1/20 0.40
MAPT P10636 6/20 0.40
SMN1; SMN2 Q16637 2/20 0.40
TSHR P16473 1/20 0.40
HSD17B10 Q99714 1/20 0.40
TP53 P04637 2/20 0.39
LMNA P02545 2/20 0.39
THRB P10828 3/20 0.39
THRA P10827 1/20 0.39
PRSS1 P07477 1/20 0.38
ACR P10323 1/20 0.38
POLB P06746 2/20 0.38
NFKB1 P19838 1/20 0.37
NFKB2 Q00653 1/20 0.37

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
SCHEMBL8914081 0.96 F2 (0.45) F2MGLLALDH1A1CYP1A2CYP2D6
SCHEMBL8919726 0.89 LMNA (0.49) MGLLALDH1A1CYP1A2CYP2D6HIF1A
SCHEMBL8913763 0.89 LMNA (0.49) MGLLALDH1A1CYP1A2CYP2D6HIF1A
SCHEMBL9307105 0.89 F2 (0.47) F2MGLLALDH1A1CYP1A2CYP2D6
SCHEMBL8913267 0.86 MAPT (0.50) MGLLALDH1A1CYP1A2CYP2D6MAPT
SCHEMBL8912381 0.86 MAPT (0.51) F2MGLLALDH1A1CYP1A2CYP2D6
SCHEMBL9303224 0.86 MAPT (0.50) MGLLALDH1A1CYP1A2CYP2D6MAPT
SCHEMBL16848604 0.86 F2 (0.52) F2MGLLALDH1A1CYP1A2CYP2D6
SCHEMBL16848610 0.86 F2 (0.52) F2MGLLALDH1A1CYP1A2CYP2D6
SCHEMBL16848602 0.86 F2 (0.52) F2MGLLALDH1A1CYP1A2CYP2D6

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 3 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-5277838-A Silylated benzoic acid derivatives CONSORTIUM FUR ELEKTROCHEMISCHE INDUSTRIE GMBH (DE) 1994-01-11 US disclosed
US-5106530-A Liquid crystals Consortium Fur Elektrochemische Ind. (DE) 1992-04-21 US disclosed