SCHEMBL8307428

SCHEMBL8307428

CCCCCCCCCCOc1ccc(-c2nc3cc(C(C)=O)ccc3o2)cc1

nearest known ligand 0.58

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MAPT P10636 12/20 0.58
TP53 P04637 1/20 0.58
RXFP1 Q9HBX9 3/20 0.58
THRB P10828 2/20 0.58
HDAC6 Q9UBN7 1/20 0.53
CETP P11597 1/20 0.52
CEPT1 Q9Y6K0 1/20 0.52
RARB P10826 3/20 0.51
P2RY14 Q15391 1/20 0.49
GAA P10253 1/20 0.49
KDM4E B2RXH2 2/20 0.48
ALDH1A1 P00352 2/20 0.48
HSD17B10 Q99714 2/20 0.48
USP2 O75604 1/20 0.48
TSHR P16473 1/20 0.48
HPGD P15428 1/20 0.48

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
SCHEMBL7333665 0.92 RARB (0.62) MAPTTP53RXFP1THRBHDAC6
SCHEMBL8308595 0.92 RARB (0.62) MAPTTP53RXFP1THRBHDAC6
SCHEMBL8307382 0.89 MAPT (0.54) MAPTTP53RXFP1THRBHDAC6
SCHEMBL8306605 0.89 MAPT (0.54) MAPTTP53RXFP1THRBHDAC6
SCHEMBL7606471 0.89 MAPT (0.55) MAPTTP53RXFP1THRBHDAC6
SCHEMBL9001602 0.87 MAPT (0.53) MAPTTP53RXFP1THRBHDAC6
SCHEMBL9001548 0.86 MAPT (0.58) MAPTTP53RXFP1THRBKDM4E
SCHEMBL9001558 0.84 ESR1 (0.60) MAPTTP53RXFP1THRB
SCHEMBL9001546 0.83 SMN1; SMN2 (0.62) MAPTTP53RXFP1THRBKDM4E
SCHEMBL8304830 0.82 RAB9A (0.54) MAPTTP53HDAC6CETPCEPT1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0462578-B1 Mesomorphic compound for use in liquid crystal composition and liquid crystal device and display apparatus using same CANON KK (JP) 1999-09-22 EP disclosed
EP-0460703-B1 Mesomorphic compound, liquid crystal composition, liquid crystal device, display apparatus and display method CANON KK (JP) 1996-09-04 EP disclosed
US-5318720-A Liquid crystal composition, liquid crystal device, display apparatus and display method CANON KABUSHIKI KAISHA (JP) 1994-06-07 US disclosed
US-5244596-A Benzoxazoles CANON KABUSHIKI KAISHA (JP) 1993-09-14 US disclosed
EP-0462578-A1 Mesomorphic compound for use in liquid crystal composition and liquid crystal device and display apparatus using same CANON KABUSHIKI KAISHA (JP) 1991-12-27 EP disclosed
EP-0460703-A1 Mesomorphic compound, liquid crystal composition, liquid crystal device, display apparatus and display method CANON KABUSHIKI KAISHA (JP) 1991-12-11 EP disclosed