SCHEMBL8913312

SCHEMBL8913312

CCCCc1ccc(OC(=O)c2ccc(CCCC[Si](C)(C)O[Si](C)(C)C)cc2)cc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.51
SMN1; SMN2 Q16637 3/20 0.51
THRB P10828 5/20 0.47
THRA P10827 2/20 0.45
NPC1 O15118 2/20 0.44
LMNA P02545 2/20 0.44
CYP1A2 P05177 1/20 0.44
CYP3A4 P08684 1/20 0.44
CYP2D6 P10635 1/20 0.44
CYP2C9 P11712 1/20 0.44
CYP2C19 P33261 1/20 0.44
KMT2A Q03164 3/20 0.43
NFKB1 P19838 1/20 0.43
NFKB2 Q00653 1/20 0.43
RELA Q04206 1/20 0.43
PRSS1 P07477 1/20 0.42
ACR P10323 1/20 0.42
RARB P10826 1/20 0.42
PLK1 P53350 1/20 0.42
PLA2G1B P04054 1/20 0.41

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
SCHEMBL8913267 0.99 MAPT (0.50) MAPTSMN1; SMN2THRBTHRANPC1
SCHEMBL9303224 0.99 MAPT (0.50) MAPTSMN1; SMN2THRBTHRANPC1
SCHEMBL8912855 0.92 LMNA (0.56) MAPTSMN1; SMN2THRBNPC1LMNA
SCHEMBL8913741 0.91 MAPT (0.49) MAPTSMN1; SMN2THRBTHRANPC1
SCHEMBL8915996 0.91 LMNA (0.58) MAPTSMN1; SMN2NPC1LMNACYP1A2
SCHEMBL9304067 0.91 LMNA (0.54) MAPTSMN1; SMN2THRBNPC1LMNA
SCHEMBL8913492 0.87 MAPT (0.55) MAPTSMN1; SMN2THRBTHRANPC1
SCHEMBL8913572 0.86 MAPT (0.54) MAPTSMN1; SMN2THRBTHRANPC1
SCHEMBL8921077 0.86 MAPT (0.56) MAPTSMN1; SMN2THRBNPC1LMNA
SCHEMBL8912149 0.85 F2 (0.44) MAPTSMN1; SMN2THRBTHRANPC1

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