SCHEMBL7920958

SCHEMBL7920958

CCOC(=O)COc1ccc(CCCOS(C)(=O)=O)cc1

nearest known ligand 0.57

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
GAA P10253 2/20 0.57
NPSR1 Q6W5P4 1/20 0.57
PPARA Q07869 2/20 0.48
PPARG P37231 1/20 0.48
POLB P06746 1/20 0.47
TSHR P16473 4/20 0.47
ALDH1A1 P00352 2/20 0.47
TP53 P04637 2/20 0.47
ALOX15 P16050 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.46
TBXAS1 P24557 1/20 0.44
PTPN1 P18031 1/20 0.43
KDM4E B2RXH2 2/20 0.43
HSD17B10 Q99714 2/20 0.43
MAPT P10636 1/20 0.43
HPGD P15428 1/20 0.43
ATM Q13315 1/20 0.42

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
SCHEMBL6374518 0.92 GAA (0.59) GAANPSR1PPARAPPARGPOLB
SCHEMBL3680514 0.84 NPSR1 (0.57) GAANPSR1PPARAPPARGPOLB
SCHEMBL7635754 0.84 FFAR1 (0.51) PPARAALDH1A1ALOX15SMN1; SMN2TBXAS1
SCHEMBL6616437 0.83 NQO1 (0.45) PPARAPPARGTSHRALDH1A1ALOX15
SCHEMBL11817150 0.82 PPARA (0.63) GAANPSR1PPARAPPARGALDH1A1
SCHEMBL13508337 0.81 GAA (0.57) GAANPSR1PPARAPPARGPOLB
SCHEMBL12869146 0.81 PPARA (0.69) GAANPSR1PPARAPPARG
SCHEMBL6054818 0.81 GAA (0.52) GAANPSR1PPARAPPARGPOLB
SCHEMBL6620386 0.81 CA12 (0.50) TSHRALDH1A1SMN1; SMN2KDM4E
SCHEMBL15922116 0.80 PPARA (0.71) GAANPSR1PPARAPPARGALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0811375-B1 GLUTAMIC ACID RECEPTOR AGONIST NIPPON SUISAN KAISHA LTD (JP) 2001-01-03 EP disclosed
US-5955505-A TREATING NERVE DEGENERATIVE DISORDERS NIPPON SUISAN KAISHA, LTD. (JP) 1999-09-21 US disclosed
EP-0811375-A1 GLUTAMIC ACID RECEPTOR AGONIST NIPPON SUISAN KAISHA, LTD. (JP) 1997-12-10 EP disclosed
EP-0469901-B1 Sulfonamide derivatives TAISHO PHARMACEUTICAL CO LTD (JP) 1994-10-19 EP disclosed
US-5189211-A Thromboxane A2 antagonists TAISHO PHARMACEUTICAL CO., LTD. (JP) 1993-02-23 US disclosed
EP-0469901-A1 Sulfonamide derivatives TAISHO PHARMACEUTICAL CO. LTD (JP) 1992-02-05 EP disclosed