SCHEMBL7920364

SCHEMBL7920364

COC(=O)COc1ccc(SCCNS(=O)(=O)c2c(C(C)C)cc(C(C)C)cc2C(C)C)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.47
CYP2C9 P11712 1/20 0.47
CYP2C19 P33261 1/20 0.47
GAA P10253 2/20 0.40
PSEN1 P49768 1/20 0.39
PSEN2 P49810 1/20 0.39
APH1B Q8WW43 1/20 0.39
NCSTN Q92542 1/20 0.39
APH1A Q96BI3 1/20 0.39
PSENEN Q9NZ42 1/20 0.39
TSHR P16473 4/20 0.39
LMNA P02545 3/20 0.39
HTT P42858 3/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
L3MBTL1 Q9Y468 1/20 0.38
MAPK1 P28482 1/20 0.38
GRIN1 Q05586 1/20 0.38
GRIN2B Q13224 1/20 0.38
ADRB3 P13945 1/20 0.37
POLB P06746 1/20 0.37

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
SCHEMBL7919255 0.91 PSEN1 (0.48) ALDH1A1CYP2C9GAAPSEN1PSEN2
SCHEMBL7911928 0.81 ALDH1A1 (0.50) ALDH1A1CYP2C9CYP2C19TSHRLMNA
SCHEMBL7920576 0.81 ALDH1A1 (0.52) ALDH1A1CYP2C9CYP2C19GAATSHR
SCHEMBL8437982 0.80 PSEN1 (0.44) ALDH1A1GAAPSEN1PSEN2APH1B
SCHEMBL7919288 0.78 ALDH1A1 (0.66) ALDH1A1CYP2C9CYP2C19TSHRLMNA
SCHEMBL7919345 0.78 ALDH1A1 (0.59) ALDH1A1CYP2C9CYP2C19GAATSHR
SCHEMBL7919314 0.78 ALDH1A1 (0.44) ALDH1A1GAATSHRHSD17B10
SCHEMBL7918958 0.77 ALDH1A1 (0.65) ALDH1A1CYP2C9CYP2C19TSHRLMNA
SCHEMBL7919042 0.76 ALDH1A1 (0.49) ALDH1A1CYP2C9CYP2C19GAATSHR
SCHEMBL7911909 0.76 ALDH1A1 (0.63) ALDH1A1CYP2C9CYP2C19GAATSHR

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