SCHEMBL7924092

SCHEMBL7924092

COC(=O)COc1ccc(SCCNS(=O)(=O)c2cc(Cl)cc(Cl)c2O)cc1

nearest known ligand 0.50

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ACLY P53396 10/20 0.50
ALDH1A1 P00352 3/20 0.46
CYP2C9 P11712 1/20 0.46
CYP2C19 P33261 1/20 0.46
HTT P42858 2/20 0.45
GAA P10253 1/20 0.45
TSHR P16473 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
LMNA P02545 1/20 0.44
GRIN1 Q05586 1/20 0.43
GRIN2B Q13224 1/20 0.43
PTGS2 P35354 1/20 0.41
CTSD P07339 1/20 0.41

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
SCHEMBL7924098 0.88 ALDH1A1 (0.47) ALDH1A1CYP2C9CYP2C19HTTGAA
SCHEMBL7919042 0.86 ALDH1A1 (0.49) ALDH1A1CYP2C9CYP2C19HTTGAA
SCHEMBL7924121 0.78 GRIN1 (0.46) ALDH1A1HTTGAATSHRLMNA
SCHEMBL7919288 0.77 ALDH1A1 (0.66) ALDH1A1CYP2C9CYP2C19HTTTSHR
SCHEMBL7919269 0.76 ALDH1A1 (0.50) ALDH1A1CYP2C9CYP2C19HTTGAA
SCHEMBL7911928 0.76 ALDH1A1 (0.50) ALDH1A1CYP2C9CYP2C19HTTTSHR
SCHEMBL7918880 0.76 ALDH1A1 (0.52) ALDH1A1CYP2C9CYP2C19HTTGAA
SCHEMBL7918958 0.76 ALDH1A1 (0.65) ALDH1A1CYP2C9CYP2C19HTTTSHR
SCHEMBL7920576 0.76 ALDH1A1 (0.52) ALDH1A1CYP2C9CYP2C19HTTGAA
SCHEMBL7911909 0.75 ALDH1A1 (0.63) ALDH1A1CYP2C9CYP2C19HTTGAA

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