SCHEMBL8912401

SCHEMBL8912401

CC[Si](C)(C)CCCCCCc1ccc(C(=O)O)cc1.N#Cc1ccc(-c2ccccc2)cc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RARB P10826 8/20 0.53
MEN1 O00255 1/20 0.53
ALDH1A1 P00352 1/20 0.53
RARA P10276 1/20 0.53
MAPT P10636 1/20 0.53
MTOR P42345 1/20 0.53
KMT2A Q03164 1/20 0.53
TSHR P16473 1/20 0.51
HSD17B10 Q99714 1/20 0.51
FAAH O00519 2/20 0.48
AR P10275 1/20 0.43
TAS2R14 Q9NYV8 1/20 0.42
NPC1 O15118 1/20 0.41
NFKB1 P19838 1/20 0.41
RAB9A P51151 1/20 0.41
NFKB2 Q00653 1/20 0.41
RELA Q04206 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
ABCB1 P08183 1/20 0.41
HPGD P15428 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
SCHEMBL4827176 0.86 RARB (0.72) RARBMEN1ALDH1A1RARAMAPT
SCHEMBL8913600 0.85 RARB (0.48) RARBMEN1ALDH1A1RARAMAPT
SCHEMBL4651820 0.85 RARB (0.72) RARBMEN1ALDH1A1RARAMAPT
SCHEMBL4826735 0.84 RARB (0.71) RARBMEN1ALDH1A1RARAMAPT
SCHEMBL9153598 0.82 RARB (0.59) RARBMEN1ALDH1A1RARAMAPT
SCHEMBL4826432 0.81 RARB (0.57) RARBMEN1ALDH1A1RARAMAPT
SCHEMBL9155362 0.81 TSHR (0.57) TSHRHSD17B10FAAH
SCHEMBL10817566 0.79 RARB (0.57) RARBMEN1ALDH1A1RARAMAPT
SCHEMBL4828278 0.78 ALDH1A1 (0.59) RARBMEN1ALDH1A1RARAMAPT
SCHEMBL8912406 0.78 RARB (0.50) RARBMEN1ALDH1A1RARAMAPT

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