SCHEMBL5095993

SCHEMBL5095993

C=CCOc1ccc(C(=O)O)c(-c2ccc(-c3ccccc3)cc2)c1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 2/20 0.47
TSHR P16473 1/20 0.47
MEN1 O00255 2/20 0.46
KMT2A Q03164 2/20 0.46
LMNA P02545 1/20 0.46
MAPT P10636 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
BACE1 P56817 1/20 0.45
KAT6A Q92794 1/20 0.43
ALDH2 P05091 1/20 0.43
MAOA P21397 1/20 0.43
MAOB P27338 1/20 0.43
HNF4A P41235 1/20 0.42
ACMSD Q8TDX5 1/20 0.42
FFAR1 O14842 1/20 0.42
DCLRE1A Q6PJP8 1/20 0.41
DCLRE1B Q9H816 1/20 0.41
MCL1 Q07820 1/20 0.41
KDM4E B2RXH2 2/20 0.41
NPC1 O15118 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
SCHEMBL8850740 0.97 GAA (0.49) GAATSHRMEN1KMT2ALMNA
SCHEMBL9127370 0.89 ALDH2 (0.54) GAATSHRMEN1KMT2ALMNA
SCHEMBL9446930 0.88 SMN1; SMN2 (0.54) GAATSHRMEN1KMT2ALMNA
SCHEMBL4577989 0.88 GAA (0.48) GAATSHRMEN1KMT2ALMNA
SCHEMBL8962717 0.86 RARB (0.53) TSHRSMN1; SMN2FFAR1MCL1KDM4E
SCHEMBL9194383 0.86 MMP2 (0.47) GAATSHRMEN1KMT2ALMNA
SCHEMBL18763585 0.86 ALDH1A1 (0.53) ALDH2MAOAMAOBFFAR1MCL1
SCHEMBL2364297 0.85 MMP2 (0.45) GAATSHRMEN1KMT2ALMNA
SCHEMBL9446917 0.85 SMN1; SMN2 (0.45) GAATSHRMEN1KMT2ALMNA
SCHEMBL9446935 0.84 GAA (0.48) GAATSHRMEN1KMT2ALMNA

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7396486-B2 Polymerizable mixtures WACKER CHEMIE AG (DE) 2008-07-08 US disclosed
US-20060097224-A1 Polymerisable mixtures WACKER CHEMIE AG (DE) 2006-05-11 US disclosed
EP-0471277-B1 Silanol compounds, polymerizable monomers and polymers having mesogenic groups SAGAMI CHEM RES (JP) 1995-11-15 EP disclosed
US-5329034-A Silanol compounds, polymerizable monomers and polymers having mesogenic groups SAGAMI CHEMICAL RESEARCH CENTER (JP) 1994-07-12 US disclosed
EP-0471277-A2 Silanol compounds, polymerizable monomers and polymers having mesogenic groups SAGAMI CHEMICAL RESEARCH CENTER (JP) 1992-02-19 EP disclosed