SCHEMBL3354777

SCHEMBL3354777

CC(C)(c1ccc(O)cc1)c1ccc(CC(c2ccc(O)cc2)c2ccc(O)cc2)cc1

nearest known ligand 0.57

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 16/20 0.57
ESR2 Q92731 16/20 0.57
CYP3A4 P08684 3/20 0.57
SLC6A2 P23975 2/20 0.57
AR P10275 1/20 0.57
HPGD P15428 1/20 0.57
TSHR P16473 1/20 0.57
SLC6A4 P31645 1/20 0.57
HTR6 P50406 1/20 0.57
ESRRG P62508 1/20 0.57
SLC6A3 Q01959 1/20 0.57
HSD17B10 Q99714 1/20 0.57
ALDH1A1 P00352 2/20 0.55
TAAR1 Q96RJ0 2/20 0.44
MEN1 O00255 1/20 0.43
CYP1A2 P05177 1/20 0.43
CYP2C9 P11712 1/20 0.43
CYP2C19 P33261 1/20 0.43
KMT2A Q03164 1/20 0.43

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
SCHEMBL15475852 1.00 ESR1 (0.57) ESR1ESR2CYP3A4SLC6A2AR
SCHEMBL28340138 0.92 ESR1 (0.59) ESR1ESR2CYP3A4SLC6A2AR
Orthocresol SCHEMBL29223985 0.87 ESR1 (0.50) ESR1ESR2CYP3A4SLC6A2AR
SCHEMBL30320268 0.86 ESR1 (0.43) ESR1ESR2CYP3A4SLC6A2AR
SCHEMBL28680993 0.86 ESR1 (0.43) ESR1ESR2CYP3A4SLC6A2AR
SCHEMBL231792 0.84 ESR1 (0.61) ESR1ESR2CYP3A4SLC6A2ALDH1A1
SCHEMBL10456186 0.84 ESR1 (0.76) ESR1ESR2CYP3A4SLC6A2AR
SCHEMBL28684690 0.83 ESR1 (0.53) ESR1ESR2CYP3A4SLC6A2AR
SCHEMBL5679013 0.82 ESR1 (0.44) ESR1ESR2CYP3A4SLC6A2AR
Bisphenol A SCHEMBL268449 0.81 ESR1 (0.61) ESR1ESR2CYP3A4SLC6A2AR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0591984-B1 Resin composition for aqueous paint KANSAI PAINT CO LTD (JP) 1997-07-09 EP claimed
US-9256126-B2 Methanofullerenes IRRESISTIBLE MATERIALS LTD (GB) 2016-02-09 US disclosed
WO-2014137663-A1 METHANOFULLERENES ROBINSON ALEX PHILIP GRAHAM (GB) 2014-09-12 WO disclosed
US-20140134843-A1 Methanofullerenes IRRESISTIBLE MATERIALS LTD (GB) 2014-05-15 US disclosed
EP-2460856-A1 POLYCARBONATE RESIN COMPOSITION Idemitsu Kosan Co., Ltd. (JP) 2012-06-06 EP disclosed
EP-1806618-B1 POSITIVE PHOTOSENSITIVE INSULATING RESIN COMPOSITION AND CURED PRODUCT THEREOF JSR CORP (JP) 2010-06-09 EP disclosed
EP-1806618-A1 POSITIVE PHOTOSENSITIVE INSULATING RESIN COMPOSITION AND CURED PRODUCT THEREOF JSR Corporation (JP) 2007-07-11 EP disclosed
EP-1469353-A1 TWO-LAYER FILM AND METHOD OF FORMING PATTERN WITH THE SAME JSR Corporation (JP) 2004-10-20 EP disclosed
US-20020086934-A1 Anti-reflection coating forming composition JSR CORPORATION (JP) 2002-07-04 US disclosed
EP-0695316-A1 URETHANE MODIFIED EPOXY RESIN COMPOSITIONS Ciba SC Holding AG (CH) 1996-02-07 EP disclosed
WO-1995021879-A1 URETHANE MODIFIED EPOXY RESIN COMPOSITIONS CIBA-GEIGY AG (CH) 1995-08-17 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20140134843-A1 Methanofullerenes WASF2, ERCC4, TUFM ESR1 1036/4885ESR2 1065/4885CYP3A4 1344/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.