SCHEMBL51686

SCHEMBL51686

CC(c1ccc(C(C)(C)c2ccccc2)cc1O)c1ccc(C(C)(C)c2ccccc2)cc1O

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 6/20 0.53
ESR2 Q92731 5/20 0.53
CYP3A4 P08684 2/20 0.53
ALDH1A1 P00352 2/20 0.53
CNR1 P21554 4/20 0.53
CNR2 P34972 4/20 0.53
TYR P14679 1/20 0.49
RORC P51449 1/20 0.47
HPGD P15428 2/20 0.41
HSD17B10 Q99714 2/20 0.41
AR P10275 1/20 0.41
TSHR P16473 1/20 0.41
SLC6A2 P23975 1/20 0.41
SLC6A4 P31645 1/20 0.41
HTR6 P50406 1/20 0.41
ESRRG P62508 1/20 0.41
SLC6A3 Q01959 1/20 0.41
KLF10 Q13118 1/20 0.40
ALOX15 P16050 2/20 0.38
ALOX12 P18054 1/20 0.38

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
SCHEMBL51353 0.86 RORC (0.60) ESR1ESR2CYP3A4ALDH1A1CNR1
SCHEMBL1345546 0.81 RORC (0.54) ESR1ESR2CYP3A4ALDH1A1CNR1
SCHEMBL1345272 0.81 RORC (0.54) ESR1ESR2CYP3A4ALDH1A1CNR1
SCHEMBL1344986 0.81 RORC (0.54) ESR1ESR2CYP3A4ALDH1A1CNR1
SCHEMBL1343545 0.81 RORC (0.54) ESR1ESR2CYP3A4ALDH1A1CNR1
SCHEMBL8024041 0.80 ESR1 (0.63) ESR1ESR2CYP3A4ALDH1A1CNR1
SCHEMBL52009 0.80 ALDH1A1 (0.59) ESR1ALDH1A1CNR1CNR2TYR
SCHEMBL27912180 0.79 RORC (0.60) ESR1ESR2CYP3A4ALDH1A1CNR1
SCHEMBL28379591 0.78 TYR (0.65) ESR1ESR2CYP3A4ALDH1A1TYR
SCHEMBL29827185 0.78 TYR (0.65) ESR1ESR2CYP3A4ALDH1A1TYR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2181853-B1 Thermosensitive recording medium JUJO PAPER CO LTD (JP) 2015-09-23 EP disclosed
US-8492308-B2 Thermosensitive recording medium NIPPON PAPER INDUSTRIES CO., LTD. (JP) 2013-07-23 US disclosed
US-8129307-B2 Thermosensitive recording medium NIPPON PAPER INDUSTRIES CO., LTD. (JP) 2012-03-06 US disclosed
US-20110269622-A1 THERMOSENSITIVE RECORDING MEDIUM NIPPON PAPER INDUSTRIES CO., LTD. (JP) 2011-11-03 US disclosed
US-20110130281-A1 THERMOSENSITIVE RECORDING MEDIUM API CORPORATION 2011-06-02 US disclosed
EP-2112001-B1 THERMOSENSITIVE RECORDING MEDIUM JUJO PAPER CO LTD (JP) 2011-05-11 EP disclosed
EP-2261045-A1 HEAT-SENSITIVE RECORDING MEDIUM Nippon Paper Industries Co., Ltd. (JP) 2010-12-15 EP disclosed
EP-2181853-A1 THERMAL RECORDING MATERIAL Nippon Paper Industries Co., Ltd. (JP) 2010-05-05 EP disclosed
US-20100099557-A1 Thermosensitive Recording Medium NIPPON PAPER INDUSTRIES CO., LTD. (JP) 2010-04-22 US disclosed