SCHEMBL9716693

SCHEMBL9716693

O=C(O)c1ccc(C(=O)Oc2ccc(O)cc2-c2ccccc2)cc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 2/20 0.56
ESR2 Q92731 2/20 0.56
RXRA P19793 1/20 0.50
RXRB P28702 1/20 0.50
RXRG P48443 1/20 0.50
EGFR P00533 3/20 0.47
SERPINE1 P05121 1/20 0.44
SELL P14151 1/20 0.43
SELP P16109 1/20 0.43
POLB P06746 1/20 0.43
POLA1 P09884 1/20 0.43
ANTXR2 P58335 1/20 0.43
CA12 O43570 1/20 0.43
CA1 P00915 1/20 0.43
CA2 P00918 1/20 0.43
CA3 P07451 1/20 0.43
TYR P14679 1/20 0.43
DRD1 P21728 1/20 0.43
CA4 P22748 1/20 0.43
CA6 P23280 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
SCHEMBL9857403 0.95 ESR2 (0.56) ESR1ESR2RXRARXRBRXRG
SCHEMBL767483 0.94 ESR1 (0.55) ESR1ESR2RXRARXRBRXRG
SCHEMBL8849838 0.89 ESR1 (0.50) ESR1ESR2EGFRSERPINE1SELL
SCHEMBL10783364 0.85 KMT2A (0.50) ESR1ESR2RXRARXRBRXRG
SCHEMBL777827 0.84 KMT2A (0.49) ESR1ESR2EGFRSERPINE1SELL
SCHEMBL27898043 0.81 RXRA (0.55) ESR1ESR2RXRARXRBRXRG
SCHEMBL777890 0.80 KMT2A (0.52) ESR1ESR2POLBCA12CA9
SCHEMBL9513770 0.78 BACE1 (0.56) ESR1ESR2ALOX5KMT2AKDM4E
Terephthalic Acid SCHEMBL9857404 0.78 EGFR (0.56) ESR2RXRARXRBRXRGEGFR
SCHEMBL14981353 0.78 KMT2A (0.53) ESR1ESR2CA9MAPTKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0476471-A2 High modulus polymeric composition THE GOODYEAR TIRE & RUBBER COMPANY (US) 1992-03-25 EP disclosed
EP-0429654-A1 LIQUID-CRYSTAL POLYESTER CONTAINER AND MANUFACTURE THEREOF TOYO SEIKAN KAISHA, LTD. (JP) 1991-06-05 EP disclosed
EP-0314785-A1 BIAXIALLY ORIENTED POLYESTER FILM TORAY INDUSTRIES, INC. (JP) 1989-05-10 EP disclosed
US-4798875-A POLYESTER BLEND TORAY INDUSTRIES, INC. (JP) 1989-01-17 US disclosed
US-4699746-A Process of making high tenacity as-spun anisotropic melt fibers E. I. DU PONT DE NEMOURS AND COMPANY (US) 1987-10-13 US disclosed
US-4612362-A Thermotropic polyester-carbonates containing 2,2-dimethyl-1,3-propanediol ALLIED CORPORATION (US) 1986-09-16 US disclosed
US-4612154-A Spinning of certain high molecular weight anisotropic melt forming polyesters E. I. DU PONT DE NEMOURS AND COMPANY (US) 1986-09-16 US disclosed
EP-0165073-A2 Improved spinning process E.I. DU PONT DE NEMOURS AND COMPANY (US) 1985-12-18 EP disclosed
US-4435561-A Temperature stable thermotropic poly(ester carbonate) containing high amounts of readily available diols ALLIED CORPORATION (US) 1984-03-06 US disclosed
US-4398018-A Temperature stable thermotropic poly(ester carbonate) derived from t-butylhydroquinone ALLIED CORPORATION (US) 1983-08-09 US disclosed