SCHEMBL9710261

SCHEMBL9710261

C#Cc1ccc(OCCCCCCC=C)c(F)c1F

nearest known ligand 0.33

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
ESR1 P03372 1/20 0.32
USP2 O75604 1/20 0.32
HPGD P15428 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
LPAR3 Q9UBY5 2/20 0.31
LPAR2 Q9HBW0 1/20 0.31
EGFR P00533 1/20 0.30

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
SCHEMBL9706357 0.81 ALDH1A1 (0.45) ALDH1A1L3MBTL1ESR1HPGDLPAR2
SCHEMBL9706445 0.81 ALDH1A1 (0.45) ALDH1A1L3MBTL1ESR1HPGDLPAR2
SCHEMBL9710347 0.81 ALDH1A1 (0.45) ALDH1A1L3MBTL1ESR1HPGDLPAR2
SCHEMBL15087089 0.79 ALDH1A1 (0.43) ALDH1A1L3MBTL1HPGDLPAR2
SCHEMBL9710346 0.78 ALDH1A1 (0.36) ALDH1A1L3MBTL1ESR1USP2HPGD
SCHEMBL16692011 0.73 L3MBTL1 (0.37) ALDH1A1L3MBTL1USP2HPGDTDP1
SCHEMBL9710295 0.73 L3MBTL1 (0.42) ALDH1A1L3MBTL1USP2HPGDTDP1
SCHEMBL9699978 0.73 L3MBTL1 (0.42) ALDH1A1L3MBTL1USP2HPGDTDP1
SCHEMBL1512654 0.72 ALDH1A1 (0.41) ALDH1A1L3MBTL1ESR1HPGD
SCHEMBL31267901 0.71 L3MBTL1 (0.44) ALDH1A1L3MBTL1USP2HPGDTDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0518636-A1 Liquid crystal compounds and compositions SANYO CHEMICAL INDUSTRIES LTD. (JP) 1992-12-16 EP disclosed