SCHEMBL8024041

SCHEMBL8024041

CC(C)(c1ccccc1)c1ccc(O)c(O)c1

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 9/20 0.63
ESR2 Q92731 5/20 0.63
ALDH1A1 P00352 2/20 0.63
CYP3A4 P08684 2/20 0.63
CNR1 P21554 4/20 0.60
CNR2 P34972 4/20 0.60
HPGD P15428 2/20 0.59
HSD17B10 Q99714 2/20 0.59
ALOX15 P16050 2/20 0.59
TDP1 Q9NUW8 1/20 0.59
KLF10 Q13118 1/20 0.50
AR P10275 1/20 0.48
TSHR P16473 1/20 0.48
SLC6A2 P23975 1/20 0.48
SLC6A4 P31645 1/20 0.48
HTR6 P50406 1/20 0.48
ESRRG P62508 1/20 0.48
SLC6A3 Q01959 1/20 0.48
ALOX12 P18054 1/20 0.47
RORC P51449 1/20 0.46

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
SCHEMBL5674836 0.91 ALDH1A1 (0.70) ESR1ESR2ALDH1A1CYP3A4CNR1
SCHEMBL1346737 0.89 ESR1 (0.67) ESR1ESR2ALDH1A1CYP3A4CNR1
SCHEMBL1501111 0.89 ALDH1A1 (0.73) ESR1ESR2ALDH1A1CYP3A4CNR1
SCHEMBL2692670 0.86 ESR1 (0.80) ESR1ESR2ALDH1A1CYP3A4CNR1
SCHEMBL30549330 0.85 ESR1 (0.70) ESR1ESR2ALDH1A1CYP3A4CNR1
SCHEMBL5075019 0.85 ESR1 (0.70) ESR1ESR2ALDH1A1CYP3A4CNR1
SCHEMBL745012 0.84 ESR1 (0.59) ESR1ESR2ALDH1A1CYP3A4CNR1
SCHEMBL29547368 0.84 ESR1 (0.59) ESR1ESR2ALDH1A1CYP3A4CNR1
SCHEMBL10335292 0.84 ESR1 (0.60) ESR1ESR2ALDH1A1CYP3A4CNR1
SCHEMBL647966 0.84 ESR1 (0.59) ESR1ESR2ALDH1A1CYP3A4CNR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-104159658-B Reinforced thermoplastic articles, compositions for making the articles, methods of making, and articles formed therefrom 沙特基础全球技术有限公司 2017-02-22 CN disclosed
EP-0754564-B1 Heat sensitive recording material and recording method. MITSUBISHI PAPER MILLS LTD (JP) 2000-03-01 EP disclosed
US-5876898-A MULTICOLOR RECORDING OF HIGH CONTRAST MITSUBISHI PAPER MILLS LIMITED (JP) 1999-03-02 US disclosed
EP-0754564-A2 Heat sensitive recording material and recording method using the same MITSUBISHI PAPER MILLS, LTD. (JP) 1997-01-22 EP disclosed
EP-0257011-B1 PERMEATION MODIFIED ASYMMETRIC GAS SEPARATION MEMBRANES HAVING GRADED DENSITY SKINS PERMEA, Inc. (US) 1992-10-07 EP disclosed
US-4728346-A PERMSELECTIVITY PERMEA INC. (US) 1988-03-01 US disclosed
EP-0257011-A2 Permeation modified asymmetric gas separation membranes having graded density skins PERMEA, Inc. (US) 1988-02-24 EP disclosed
US-4575385-A POLYSULFONES CONTACTED WITH BENZENE COMPOUND MONSANTO COMPANY (US) 1986-03-11 US disclosed