SCHEMBL29508175

SCHEMBL29508175

CC(C)(c1ccccc1)c1ccc(O)cc1.[Na]

nearest known ligand 0.95

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESR2 Q92731 7/20 0.95
ESR1 P03372 6/20 0.95
CYP3A4 P08684 2/20 0.95
ALDH1A1 P00352 1/20 0.95
AR P10275 1/20 0.76
HPGD P15428 1/20 0.76
TSHR P16473 1/20 0.76
SLC6A2 P23975 1/20 0.76
SLC6A4 P31645 1/20 0.76
HTR6 P50406 1/20 0.76
ESRRG P62508 1/20 0.76
SLC6A3 Q01959 1/20 0.76
HSD17B10 Q99714 1/20 0.76
LMNA P02545 1/20 0.54
TYR P14679 1/20 0.54
NR3C2 P08235 3/20 0.50
CNR1 P21554 4/20 0.47
CNR2 P34972 4/20 0.47
CA12 O43570 1/20 0.46
CA1 P00915 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
SCHEMBL4310025 0.98 ESR1 (1.00) ESR2ESR1CYP3A4ALDH1A1AR
SCHEMBL9353524 0.98 ESR1 (1.00) ESR2ESR1CYP3A4ALDH1A1AR
SCHEMBL51117 0.98 ESR1 (1.00) ESR2ESR1CYP3A4ALDH1A1AR
SCHEMBL29110943 0.95 ESR1 (0.95) ESR2ESR1CYP3A4ALDH1A1AR
Phenol SCHEMBL5691556 0.95 ESR1 (0.95) ESR2ESR1CYP3A4ALDH1A1AR
Hydrogen Sulfide SCHEMBL5204816 0.95 ESR1 (0.95) ESR2ESR1CYP3A4ALDH1A1AR
Barium SCHEMBL30124542 0.95 ESR1 (0.95) ESR2ESR1CYP3A4ALDH1A1AR
SCHEMBL16568667 0.95 ESR1 (0.95) ESR2ESR1CYP3A4ALDH1A1AR
SCHEMBL29256040 0.95 ESR1 (0.95) ESR2ESR1CYP3A4ALDH1A1AR
Bisphenol A SCHEMBL30645577 0.95 ESR1 (0.86) ESR2ESR1CYP3A4ALDH1A1AR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11926733-B2 Polycarbonate copolymer blends, articles formed therefrom, and methods of manufacture SHPP GLOBAL TECHNOLOGIES B.V. (NL) 2024-03-12 US disclosed
CN-110167992-B Method for producing polyetherimide 高新特殊工程塑料全球技术有限公司 2022-10-18 CN disclosed
EP-3530700-B1 POLYCARBONATE COPOLYMER BLENDS, ARTICLES FORMED THEREFROM, AND METHODS OF MANUFACTURE SHPP GLOBAL TECH BV (NL) 2022-05-11 EP disclosed