SCHEMBL9752049

SCHEMBL9752049

Cc1cc(C(=O)c2cccc(C(=O)O)c2)ccc1O

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD17B1 P14061 5/20 0.59
HSD17B2 P37059 5/20 0.59
L3MBTL1 Q9Y468 2/20 0.52
ATM Q13315 1/20 0.52
TDP1 Q9NUW8 1/20 0.52
CA1 P00915 3/20 0.51
CA2 P00918 3/20 0.51
CA9 Q16790 3/20 0.51
POLB P06746 2/20 0.50
CA12 O43570 2/20 0.50
CA6 P23280 2/20 0.50
PTGS2 P35354 2/20 0.50
KDM4E B2RXH2 1/20 0.50
GAA P10253 1/20 0.50
MAPT P10636 1/20 0.50
CA4 P22748 1/20 0.50
CA7 P43166 1/20 0.50
CA14 Q9ULX7 1/20 0.50
NPC1 O15118 1/20 0.50
MITF O75030 1/20 0.50

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
SCHEMBL5962849 0.87 HSD17B1 (0.64) HSD17B1HSD17B2L3MBTL1ATMTDP1
SCHEMBL9752047 0.87 SRD5A2 (0.59) HSD17B1HSD17B2L3MBTL1CA1CA2
SCHEMBL172420 0.87 CA12 (0.64) L3MBTL1TDP1CA1CA2CA9
SCHEMBL29979976 0.87 CA12 (0.64) L3MBTL1TDP1CA1CA2CA9
SCHEMBL31574429 0.85 HTT (0.57) HSD17B1HSD17B2TDP1POLBMAPT
SCHEMBL1758239 0.85 HTT (0.61) HSD17B1HSD17B2TDP1POLBMAPT
SCHEMBL31621156 0.85 HTT (0.61) HSD17B1HSD17B2TDP1POLBMAPT
SCHEMBL15851049 0.84 HSD17B1 (0.60) HSD17B1HSD17B2TDP1POLBNPC1
SCHEMBL10353029 0.84 HSD17B1 (0.79) HSD17B1HSD17B2CA1CA2CA9
SCHEMBL9217699 0.84 CA1 (0.73) L3MBTL1ATMTDP1CA1CA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-3014619-A None JP disclosed
JP-H0314619-A FILAMENT OF OPTICALLY ANISOTROPIC MELT-FORMING COPOLYESTER E I DU PONT DE NEMOURS & CO 1991-01-23 JP disclosed
EP-0069587-B1 OPTICALLY ANISOTROPIC MELT FORMING POLYESTERS E.I. DU PONT DE NEMOURS AND COMPANY (US) 1985-05-22 EP disclosed
EP-0026609-B1 AROMATIC POLYESTER AND FILAMENTS E.I. DU PONT DE NEMOURS AND COMPANY (US) 1984-03-21 EP disclosed
EP-0069587-A1 Optically anisotropic melt forming polyesters E.I. DU PONT DE NEMOURS AND COMPANY (US) 1983-01-12 EP disclosed
US-4335232-A AROMATIC POLYESTER-POLYLACTONE COPOLYMERS E. I. DU PONT DE NEMOURS AND COMPANY (US) 1982-06-15 US disclosed
EP-0026609-A1 Aromatic polyester and filaments E.I. DU PONT DE NEMOURS AND COMPANY (US) 1981-04-08 EP disclosed
US-4232144-A Polyester which exhibits anisotropy in the melt containing p-oxybenzoyl units and 4-oxy-3'-carbonylbenzophenone units or methyl and chloro derivatives of said units E. I. DU PONT DE NEMOURS AND COMPANY (US) 1980-11-04 US disclosed