SCHEMBL9512608

SCHEMBL9512608

CCCCCCO[C@H](C)COS(=O)(=O)c1ccc(C)cc1

nearest known ligand 0.44

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
PLA2G2C Q5R387 1/20 0.44
MCHR1 Q99705 1/20 0.42
CA9 Q16790 5/20 0.38
CA2 P00918 4/20 0.38
CA12 O43570 2/20 0.38
RECQL P46063 2/20 0.37
GLA P06280 1/20 0.37
HPGD P15428 1/20 0.37
TSHR P16473 1/20 0.37
MAPK1 P28482 1/20 0.37
EPHX2 P34913 1/20 0.37
BLM P54132 1/20 0.37
STAT3 P40763 1/20 0.37
ALDH1A1 P00352 2/20 0.36
CA1 P00915 4/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
CYP3A4 P08684 2/20 0.35
CYP2C9 P11712 1/20 0.35
CYP2C19 P33261 1/20 0.35

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
SCHEMBL9723718 1.00 PLA2G2C (0.44) PLA2G2CMCHR1CA9CA2CA12
SCHEMBL9488453 1.00 PLA2G2C (0.44) PLA2G2CMCHR1CA9CA2CA12
SCHEMBL9723827 0.99 PLA2G2C (0.42) PLA2G2CMCHR1CA9CA2CA12
SCHEMBL9512685 0.94 CA12 (0.40) PLA2G2CMCHR1CA9CA2CA12
SCHEMBL9723867 0.94 CA12 (0.40) PLA2G2CMCHR1CA9CA2CA12
SCHEMBL9261226 0.89 CA12 (0.41) PLA2G2CCA9CA2CA12TSHR
SCHEMBL25909329 0.88 PLA2G2C (0.42) PLA2G2CMCHR1CA9CA2CA12
SCHEMBL9489603 0.87 PLA2G2C (0.42) PLA2G2CMCHR1CA9CA2CA12
SCHEMBL8944916 0.87 PLA2G2C (0.42) PLA2G2CMCHR1CA9CA2CA12
SCHEMBL9488585 0.86 PLA2G2C (0.41) PLA2G2CMCHR1CA9CA2CA12

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
EP-0277815-B1 Optically active-2-alkoxy-propyl ether and liquid crystal composition CHISSO CORP (JP) 1993-11-24 EP disclosed
US-5021191-A Ferroelectricity display elements; extremely small redution in crystal temperature region CHISSO CORPORATION (JP) 1991-06-04 US disclosed
EP-0277815-A2 Optically active-2-alkoxy-propyl ether and liquid crystal composition Chisso Corporation (JP) 1988-08-10 EP disclosed