SCHEMBL9770291

SCHEMBL9770291

COc1ccc(Oc2ccc(C)cc2)c(Sc2cc(OC)ccc2Oc2ccc(C)cc2)c1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ACHE P22303 3/20 0.48
AR P10275 2/20 0.47
CA12 O43570 1/20 0.44
CA1 P00915 1/20 0.44
CA2 P00918 1/20 0.44
CA7 P43166 1/20 0.44
CA9 Q16790 1/20 0.44
CA14 Q9ULX7 1/20 0.44
SLC6A4 P31645 2/20 0.41
MAPT P10636 4/20 0.41
ALDH1A1 P00352 4/20 0.41
MAPK1 P28482 3/20 0.41
L3MBTL1 Q9Y468 2/20 0.41
GAA P10253 1/20 0.41
HPGD P15428 1/20 0.41
ALOX15 P16050 1/20 0.41
HSD17B10 Q99714 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
RELA Q04206 1/20 0.40
MEN1 O00255 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
SCHEMBL9770336 0.86 LTA4H (0.53) CA12CA1CA2CA7CA9
SCHEMBL8738414 0.81 MAPT (0.58) ACHECA12CA1CA2CA7
SCHEMBL31345518 0.81 MAPT (0.58) ACHECA12CA1CA2CA7
SCHEMBL38663217 0.81 CA12 (0.60) CA12CA1CA2CA7CA9
SCHEMBL9487582 0.81 CA12 (0.60) CA12CA1CA2CA7CA9
Nitrogen SCHEMBL10783880 0.78 MAPT (0.55) ACHEARCA12CA1CA2
SCHEMBL17354635 0.76 ACHE (0.54) ACHEARCA12CA1CA2
SCHEMBL29110966 0.75 ACHE (0.48) ACHEMAPTALDH1A1HPGDMEN1
SCHEMBL12770839 0.75 AR (0.59) ACHEARCA12CA1CA2
SCHEMBL12770836 0.75 ACHE (0.48) ACHEARCA12CA1CA2

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
US-4981836-A Recording material FUJI PHOTO FILM CO., LTD. (JP) 1991-01-01 US disclosed
US-4835133-A Recording material FUJI PHOTO FILM CO., LTD. (JP) 1989-05-30 US disclosed
EP-0272099-A2 Color-forming sheet recording material FUJI PHOTO FILM CO., LTD. (JP) 1988-06-22 EP disclosed