SCHEMBL8915558

SCHEMBL8915558

CC(CC(c1ccc(O)cc1)c1ccc(O)cc1)(c1ccc(O)c(Cl)c1)c1ccc(O)c(Cl)c1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 8/20 0.37
ESR2 Q92731 7/20 0.37
CYP3A4 P08684 3/20 0.36
ALDH1A1 P00352 2/20 0.36
TSHR P16473 2/20 0.35
HSD17B10 Q99714 2/20 0.35
LMNA P02545 1/20 0.35
TYR P14679 1/20 0.35
AR P10275 1/20 0.35
HPGD P15428 1/20 0.35
SLC6A2 P23975 1/20 0.35
SLC6A4 P31645 1/20 0.35
HTR6 P50406 1/20 0.35
ESRRG P62508 1/20 0.35
SLC6A3 Q01959 1/20 0.35
CA1 P00915 1/20 0.35
CA2 P00918 1/20 0.35
CHEK1 O14757 1/20 0.35
FYN P06241 1/20 0.35
PDGFRB P09619 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
SCHEMBL5617933 0.85 ESR1 (0.53) ESR1ESR2CYP3A4ALDH1A1TSHR
SCHEMBL5577108 0.82 ESR1 (0.50) ESR1ESR2CYP3A4ALDH1A1TSHR
SCHEMBL21221690 0.80 RORC (0.40) ESR1ESR2CYP3A4ALDH1A1TSHR
SCHEMBL7975485 0.80 ESR1 (0.49) ESR1ESR2CYP3A4ALDH1A1TSHR
SCHEMBL23140662 0.78 ESR1 (0.51) ESR1ESR2CYP3A4ALDH1A1TSHR
SCHEMBL588807 0.76 ESR1 (0.52) ESR1ESR2CYP3A4ALDH1A1TSHR
SCHEMBL8459895 0.75 ESR1 (0.39) ESR1ESR2CYP3A4ALDH1A1TSHR
SCHEMBL7946326 0.74 HSD17B10 (0.43) ESR1ESR2CYP3A4ALDH1A1TSHR
SCHEMBL30713707 0.74 ESR1 (0.61) ESR1ESR2CYP3A4ALDH1A1TSHR
SCHEMBL10865833 0.74 ESR1 (0.61) ESR1ESR2CYP3A4ALDH1A1TSHR

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-5648409-A DURABLE COATINGS WITH CHEMICAL RESISTANCE AND ADHESION HENKEL CORPORATION (US) 1997-07-15 US disclosed
US-5565506-A REACTION PRODUCT OF EPOXY RESIN, POLYHYDRIC PHENOL AND AMINE-EPOXY ADDUCT HENKEL CORPORATION (US) 1996-10-15 US disclosed
WO-1996020971-A1 AQUEOUS SELF-DISPERSIBLE EPOXY RESIN BASED ON EPOXY-AMINE ADDUCTS CONTAINING AROMATIC POLYEPOXIDE HENKEL CORPORATION (US) 1996-07-11 WO disclosed