SCHEMBL9260592

SCHEMBL9260592

CCC(C)COCCc1ccc(C(=O)O)cc1

nearest known ligand 0.59

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.59
ALDH1A1 P00352 3/20 0.47
RARB P10826 6/20 0.46
KMT2A Q03164 2/20 0.44
MEN1 O00255 1/20 0.44
RARA P10276 1/20 0.44
MTOR P42345 1/20 0.44
MAPK1 P28482 1/20 0.42
RXRA P19793 3/20 0.41
RXRB P28702 2/20 0.41
PLA2G4B P0C869 1/20 0.39
CYP4F2 P78329 1/20 0.39
CYP4A11 Q02928 1/20 0.39
TP53 P04637 1/20 0.39
TSHR P16473 1/20 0.39

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
SCHEMBL9259790 1.00 MAPT (0.59) MAPTALDH1A1RARBKMT2AMEN1
SCHEMBL9252651 0.91 MAPT (0.56) MAPTALDH1A1RARBKMT2AMEN1
SCHEMBL9261968 0.91 MAPT (0.56) MAPTALDH1A1RARBKMT2AMEN1
SCHEMBL9259374 0.90 MAPT (0.55) MAPTALDH1A1RARBKMT2AMEN1
SCHEMBL14966729 0.86 MAPK1 (0.49) MAPTALDH1A1RARBKMT2AMEN1
SCHEMBL9260077 0.85 ALDH1A1 (0.50) MAPTALDH1A1PLA2G4BTSHR
SCHEMBL9256061 0.84 MAPT (0.62) MAPTALDH1A1RXRARXRBPLA2G4B
SCHEMBL9256064 0.84 MAPT (0.62) MAPTALDH1A1RXRARXRBPLA2G4B
SCHEMBL9262035 0.81 ESR1 (0.43) MAPTALDH1A1TP53
SCHEMBL9253922 0.81 ESR1 (0.43) MAPTALDH1A1TP53

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-5385693-A Having rapid response and low phase transition temperature SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1995-01-31 US disclosed
EP-0357372-B1 Optically active ester derivatives, preparation process thereof, liquid crystal materials and a light switching element SUMITOMO CHEMICAL CO (JP) 1994-11-17 EP disclosed
US-5264151-A Optically active ester derivatives, preparation process thereof, liquid crystal materials and a light switching element SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1993-11-23 US disclosed
US-5124070-A High speed response SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1992-06-23 US disclosed
EP-0357372-A2 Optically active ester derivatives, preparation process thereof, liquid crystal materials and a light switching element SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1990-03-07 EP disclosed