SCHEMBL9304072

SCHEMBL9304072

CCCCOc1ccc(OC(=O)c2ccc(CCC[Si]3(C)CCC(C)(C)O[Si]3(C)C)cc2)cc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PRSS1 P07477 1/20 0.43
ACR P10323 1/20 0.43
LMNA P02545 5/20 0.43
NPC1 O15118 4/20 0.43
CYP1A2 P05177 3/20 0.43
CYP2C19 P33261 3/20 0.43
CYP2C9 P11712 2/20 0.43
CYP3A4 P08684 1/20 0.43
CYP2D6 P10635 1/20 0.43
MAPT P10636 5/20 0.42
SMN1; SMN2 Q16637 4/20 0.42
KMT2A Q03164 4/20 0.42
NFKB1 P19838 3/20 0.42
NFKB2 Q00653 3/20 0.42
RELA Q04206 3/20 0.42
TSHR P16473 1/20 0.39
THRB P10828 1/20 0.38
MAPK1 P28482 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
POLB P06746 2/20 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
SCHEMBL8913744 0.93 MAPT (0.39) PRSS1ACRLMNANPC1CYP1A2
SCHEMBL8913315 0.92 MAPT (0.41) PRSS1ACRLMNANPC1CYP1A2
SCHEMBL8913271 0.91 SMN1; SMN2 (0.41) PRSS1ACRLMNANPC1MAPT
SCHEMBL9303232 0.91 SMN1; SMN2 (0.41) PRSS1ACRLMNANPC1MAPT
SCHEMBL8914086 0.88 F2 (0.38) PRSS1ACRLMNACYP1A2CYP2C9
SCHEMBL11757793 0.75 LMNA (0.66) PRSS1ACRLMNANPC1CYP1A2
SCHEMBL21084421 0.75 LMNA (0.66) PRSS1ACRLMNANPC1CYP1A2
SCHEMBL11138403 0.74 SMN1; SMN2 (0.67) PRSS1ACRLMNANPC1CYP1A2
SCHEMBL11133722 0.74 SMN1; SMN2 (0.67) PRSS1ACRLMNANPC1CYP1A2
SCHEMBL11549803 0.74 LMNA (0.68) PRSS1ACRLMNANPC1CYP1A2

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-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