SCHEMBL11907255

SCHEMBL11907255

Cc1ccc2c(C)ccc(C)c2c1O

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.44
TSHR P16473 2/20 0.44
TDP1 Q9NUW8 2/20 0.44
HPGD P15428 2/20 0.44
HSD17B10 Q99714 2/20 0.44
CYP3A4 P08684 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
CYP1A2 P05177 2/20 0.39
OPRK1 P41145 1/20 0.39
KMT2A Q03164 1/20 0.39
TRPA1 O75762 1/20 0.39
ESR1 P03372 1/20 0.36
ESR2 Q92731 1/20 0.36
KDM4E B2RXH2 5/20 0.35
HTT P42858 3/20 0.35
MAPT P10636 3/20 0.35
LMNA P02545 2/20 0.35
RAB9A P51151 2/20 0.35
NPC1 O15118 1/20 0.35
MITF O75030 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
SCHEMBL29244939 0.85 OPRK1 (0.45) ALDH1A1TSHRTDP1HPGDHSD17B10
SCHEMBL29764048 0.85 OPRK1 (0.45) ALDH1A1TSHRTDP1HPGDHSD17B10
SCHEMBL13021176 0.78 KDM4E (0.40) ALDH1A1TSHRTDP1HPGDHSD17B10
SCHEMBL10042783 0.77 ALDH1A1 (0.53) ALDH1A1TSHRTDP1HPGDHSD17B10
SCHEMBL15698061 0.75 ALDH1A1 (0.40) ALDH1A1TSHRTDP1HPGDHSD17B10
SCHEMBL44351 0.73 ALDH1A1 (0.62) ALDH1A1TSHRTDP1HPGDHSD17B10
SCHEMBL5250464 0.72 TSHR (0.48) ALDH1A1TSHRTDP1HPGDHSD17B10
SCHEMBL1673257 0.72 ALDH1A1 (0.48) ALDH1A1TSHRTDP1HPGDHSD17B10
SCHEMBL25782032 0.72 LMNA (0.42) ALDH1A1TSHRTDP1HPGDHSD17B10
SCHEMBL25782029 0.72 TRPA1 (0.38) ALDH1A1TSHRTDP1HPGDHSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2022081889-A1 METHOD AND SYSTEMS FOR PHYTOMEDICINE ANALYTICS FOR RESEARCH OPTIMIZATION AT SCALE GBS GLOBAL BIOPHARMA, INC. (CA) 2022-04-21 WO disclosed
US-8308998-B2 Polarizing film, coating liquid, and image display NITTO DENKO CORPORATION (JP) 2012-11-13 US disclosed
US-20120205822-A1 RESIN COMPOSITION FOR ENCAPSULATING SEMICONDUCTOR AND SEMICONDUCTOR DEVICE USING THE RESIN COMPOSITION SUMITOMO BAKELITE CO., LTD. (JP) 2012-08-16 US disclosed
US-20100288166-A1 POLARIZING FILM, COATING LIQUID, AND IMAGE DISPLAY NITTO DENKO CORPORATION (JP) 2010-11-18 US disclosed