SCHEMBL20306019

SCHEMBL20306019

COc1ccc(/C=C/C(=O)O[C@@H]2CCCC[C@H]2OC(=O)/C=C/c2ccc(C)cc2)cc1

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOA P21397 1/20 0.58
MAOB P27338 1/20 0.58
HTT P42858 1/20 0.56
TRPM8 Q7Z2W7 3/20 0.55
RAB9A P51151 1/20 0.55
THRB P10828 2/20 0.54
MAPT P10636 2/20 0.54
TP53 P04637 1/20 0.54
SMN1; SMN2 Q16637 1/20 0.54
RELA Q04206 1/20 0.53
F3 P13726 2/20 0.53
ATM Q13315 1/20 0.51
GPR183 P32249 1/20 0.51
GSK3B P49841 1/20 0.50
MEN1 O00255 1/20 0.50
KMT2A Q03164 1/20 0.50
HDAC3 O15379 1/20 0.49
HDAC1 Q13547 1/20 0.49
HDAC2 Q92769 1/20 0.49
HDAC8 Q9BY41 1/20 0.49

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
SCHEMBL18364671 0.94 HTT (0.61) HTTTRPM8RAB9ATHRBMAPT
SCHEMBL600597 0.82 HTT (0.70) HTTTRPM8RAB9ATHRBMAPT
SCHEMBL154420 0.82 HTT (0.70) HTTTRPM8RAB9ATHRBMAPT
SCHEMBL13899764 0.82 F3 (0.57) HTTTRPM8RAB9ATHRBMAPT
SCHEMBL17785153 0.80 TRPM8 (0.57) MAOAMAOBHTTTRPM8RAB9A
SCHEMBL17785154 0.80 TRPM8 (0.57) MAOAMAOBHTTTRPM8RAB9A
SCHEMBL12608600 0.80 HTT (0.67) HTTTRPM8RAB9ATHRBMAPT
SCHEMBL701486 0.79 USP2 (0.52) MAOAMAOBHTTTP53MEN1
SCHEMBL699090 0.78 CYP2C19 (0.51) TRPM8RAB9AMAPTSMN1; SMN2RELA
SCHEMBL11999799 0.78 F3 (0.86) MAOAMAOBRAB9ATHRBMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10007042-B2 Composition, light reflecting film, luminance-improving film, backlight unit, and liquid crystal display device FUJIFILM CORPORATION (JP) 2018-06-26 US disclosed