SCHEMBL8619219

SCHEMBL8619219

O=C(O)COc1ccc(Sc2ccc(OCC(=O)O)cc2)cc1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX15 P16050 2/20 0.63
ALDH1A1 P00352 3/20 0.58
SMN1; SMN2 Q16637 4/20 0.56
FFAR1 O14842 1/20 0.56
LMNA P02545 2/20 0.56
PTPN7 P35236 2/20 0.55
MAPT P10636 2/20 0.55
MEN1 O00255 1/20 0.55
KMT2A Q03164 1/20 0.55
PTPN12 Q05209 1/20 0.55
HPGD P15428 2/20 0.54
GAA P10253 1/20 0.54
NPSR1 Q6W5P4 1/20 0.54
TSHR P16473 2/20 0.51
NR4A1 P22736 1/20 0.51
APEX1 P27695 1/20 0.51
THRB P10828 1/20 0.50
PPARG P37231 1/20 0.47
PPARD Q03181 1/20 0.47
HSD17B10 Q99714 1/20 0.47

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
SCHEMBL11540861 0.91 PPARD (0.54) ALOX15ALDH1A1SMN1; SMN2FFAR1LMNA
SCHEMBL11178905 0.91 HPGD (0.63) ALOX15ALDH1A1SMN1; SMN2FFAR1LMNA
SCHEMBL9314961 0.88 ALOX15 (0.63) ALOX15ALDH1A1SMN1; SMN2FFAR1PTPN7
SCHEMBL339492 0.87 ALOX15 (0.81) ALOX15ALDH1A1SMN1; SMN2FFAR1LMNA
SCHEMBL8865202 0.84 ALOX15 (0.59) ALOX15ALDH1A1SMN1; SMN2FFAR1PTPN7
SCHEMBL27650744 0.84 ALOX15 (0.59) ALOX15ALDH1A1SMN1; SMN2FFAR1LMNA
SCHEMBL12892333 0.81 ALOX15 (0.55) ALOX15ALDH1A1SMN1; SMN2FFAR1PTPN7
SCHEMBL11219413 0.81 ALOX15 (0.55) ALOX15ALDH1A1SMN1; SMN2FFAR1LMNA
SCHEMBL11552274 0.80 ALOX15 (0.71) ALOX15ALDH1A1SMN1; SMN2FFAR1LMNA
SCHEMBL2780802 0.80 ALOX15 (0.71) ALOX15ALDH1A1SMN1; SMN2FFAR1PTPN7

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 21 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4574148-A Polyester resins capable of forming containers having improved gas barrier properties EASTMAN KODAK COMPANY (US) 1986-03-04 US claimed
US-4426512-A THIO- OR SULFONYL BIS((P-PHENYLENEOXY)ACETIC ACID) EASTMAN KODAK COMPANY (US) 1984-01-17 US claimed
JP-2140230-A None JP disclosed
US-11578167-B2 Sulphur-containing polyester polyols, their production and use BASF SE (DE) 2023-02-14 US disclosed
CN-110753713-B Sulfur-containing polyester polyols, their production and use 巴斯夫欧洲公司 2022-06-28 CN disclosed
US-20210095072-A1 SULPHUR-CONTAINING POLYESTER POLYOLS, THEIR PRODUCTION AND USE BASF SE (DE) 2021-04-01 US disclosed
EP-3649178-A1 SULPHUR-CONTAINING POLYESTER POLYOLS, THEIR PRODUCTION AND USE BASF SE (DE) 2020-05-13 EP disclosed
CN-110753713-A Sulfur-containing polyester polyols, their production and use 巴斯夫欧洲公司 2020-02-04 CN disclosed
WO-2019007937-A1 SULPHUR-CONTAINING POLYESTER POLYOLS, THEIR PRODUCTION AND USE BASF SE (DE) 2019-01-10 WO disclosed
EP-0886570-A1 BARRIER POLYESTER E.I. DUPONT DE NEMOURS AND COMPANY (US) 1998-12-30 EP disclosed
US-5759654-A Multiple layer preform PEPSICO INC. (US) 1998-06-02 US disclosed
EP-0466947-B1 A process for molding a multiple layer structure and a container made therefrom PEPSICO INC (US) 1996-03-27 EP disclosed
US-5443767-A Process for molding a multiple structure and a container made therein PEPSICO., INC. (US) 1995-08-22 US disclosed
EP-0466947-A1 A process for molding a multiple layer structure and a container made therefrom PepsiCo, Inc. (US) 1992-01-22 EP disclosed
US-4942008-A Process for molding a multiple layer structure PEPSICO INC. 1990-07-17 US disclosed
JP-H02140230-A POLYAMIDE POLYMER KURARAY CO LTD 1990-05-29 JP disclosed
US-4574148-A Polyester resins capable of forming containers having improved gas barrier properties EASTMAN KODAK COMPANY (US) 1986-03-04 US disclosed
US-4574148-A Polyester resins capable of forming containers having improved gas barrier properties EASTMAN KODAK COMPANY (US) 1986-03-04 US disclosed
US-4426512-A THIO- OR SULFONYL BIS((P-PHENYLENEOXY)ACETIC ACID) EASTMAN KODAK COMPANY (US) 1984-01-17 US disclosed
US-4426512-A THIO- OR SULFONYL BIS((P-PHENYLENEOXY)ACETIC ACID) EASTMAN KODAK COMPANY (US) 1984-01-17 US disclosed