SCHEMBL4798735

SCHEMBL4798735

CC(c1ccccc1)(c1ccc(O)cc1)c1ccc(O)cc1.Oc1ccc(CCc2ccc(O)cc2)cc1

nearest known ligand 0.77

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 10/20 0.77
ESR2 Q92731 9/20 0.77
MEN1 O00255 1/20 0.68
KMT2A Q03164 1/20 0.68
CYP3A4 P08684 2/20 0.59
ALDH1A1 P00352 1/20 0.59
LTA4H P09960 1/20 0.45
ESRRG P62508 2/20 0.45
LMNA P02545 1/20 0.45
TYR P14679 1/20 0.45
AR P10275 1/20 0.45
HPGD P15428 1/20 0.45
TSHR P16473 1/20 0.45
SLC6A2 P23975 1/20 0.45
SLC6A4 P31645 1/20 0.45
HTR6 P50406 1/20 0.45
SLC6A3 Q01959 1/20 0.45
HSD17B10 Q99714 1/20 0.45
ESRRB O95718 1/20 0.44
CA2 P00918 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
SCHEMBL7774227 0.89 ESR1 (0.77) ESR1ESR2MEN1KMT2ACYP3A4
SCHEMBL27277 0.88 ESR1 (1.00) ESR1ESR2MEN1KMT2ACYP3A4
SCHEMBL8031149 0.88 ESR1 (1.00) ESR1ESR2MEN1KMT2ACYP3A4
Phenol SCHEMBL29851136 0.86 ESR1 (0.95) ESR1ESR2MEN1KMT2ACYP3A4
Methane SCHEMBL16667289 0.86 ESR1 (0.95) ESR1ESR2MEN1KMT2ACYP3A4
SCHEMBL7809710 0.84 MEN1 (0.72) ESR1ESR2MEN1KMT2ACYP3A4
Phenol SCHEMBL8987629 0.83 ESR1 (0.91) ESR1ESR2MEN1KMT2ACYP3A4
SCHEMBL7917092 0.82 MEN1 (0.70) ESR1ESR2MEN1KMT2ACYP3A4
SCHEMBL23059478 0.82 ESR1 (0.87) ESR1ESR2MEN1KMT2ACYP3A4
Bicarbonate SCHEMBL19723102 0.82 ESR1 (0.87) ESR1ESR2MEN1KMT2ACYP3A4

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-9790363-B2 Polyester-polycarbonate composition and article SABIC GLOBAL TECHNOLOGIES B.V. (NL) 2017-10-17 US disclosed
EP-1957561-A1 HIGH GLASS TRANSITION TEMPERATURE COPOLYCARBONATES, METHODS OF MANUFACTURE, AND USES THEREOF General Electric Company, (a New York Corporation) (US) 2008-08-20 EP disclosed
WO-2007064670-A1 HIGH GLASS TRANSITION TEMPERATURE COPOLYCARBONATES, METHODS OF MANUFACTURE, AND USES THEREOF GENERAL ELECTRIC COMPANY (US) 2007-06-07 WO disclosed