SCHEMBL7855313

SCHEMBL7855313

[O]C/C=C/CCc1ccccc1

nearest known ligand 0.53

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
GPR52 Q9Y2T5 18/20 0.53
ALDH1A1 P00352 1/20 0.48
HPGD P15428 1/20 0.48
ALOX15 P16050 1/20 0.48
ALOX12 P18054 1/20 0.48
CASP1 P29466 1/20 0.48
HSD17B10 Q99714 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
SCHEMBL7855315 1.00 GPR52 (0.53) GPR52ALDH1A1HPGDALOX15ALOX12
SCHEMBL9715286 0.88 GPR52 (0.57) GPR52ALDH1A1HPGDALOX15ALOX12
SCHEMBL7762166 0.88 GPR52 (0.57) GPR52ALDH1A1HPGDALOX15ALOX12
SCHEMBL7762164 0.88 GPR52 (0.57) GPR52ALDH1A1HPGDALOX15ALOX12
SCHEMBL94522 0.87 HDAC3 (0.45) GPR52ALDH1A1HPGDALOX15ALOX12
SCHEMBL94523 0.87 HDAC3 (0.45) GPR52ALDH1A1HPGDALOX15ALOX12
SCHEMBL95417 0.86 GPR52 (0.53) GPR52ALDH1A1HPGDALOX15ALOX12
SCHEMBL95418 0.86 GPR52 (0.53) GPR52ALDH1A1HPGDALOX15ALOX12
SCHEMBL97631 0.84 GPR52 (0.52) GPR52ALDH1A1HPGDALOX15ALOX12
SCHEMBL11774833 0.82 ALDH1A1 (0.54) GPR52ALDH1A1HPGDALOX15ALOX12

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0719258-B1 CYCLIC AMIDE DERIVATIVES FOR PROTECTING AGAINST ULTRAVIOLET RAYS OTSUKA PHARMA CO LTD (JP) 2001-10-31 EP disclosed
US-5786367-A OXYGEN SCAVENGERS OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1998-07-28 US disclosed