SCHEMBL7920583

SCHEMBL7920583

COC(=O)COc1ccc(SCCNS(=O)(=O)c2cccnc2)cc1

nearest known ligand 0.61

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.61
ALDH1A1 P00352 8/20 0.54
CYP2C9 P11712 2/20 0.54
CYP2C19 P33261 1/20 0.54
LMNA P02545 2/20 0.52
TSHR P16473 5/20 0.51
POLB P06746 1/20 0.50
L3MBTL1 Q9Y468 1/20 0.43
HSD17B10 Q99714 2/20 0.43
CYP1A2 P05177 1/20 0.42
CYP3A4 P08684 1/20 0.42
NFKB1 P19838 1/20 0.42
PMP22 Q01453 1/20 0.42
HIF1A Q16665 1/20 0.42
KEAP1 Q14145 1/20 0.42
NFE2L2 Q16236 1/20 0.42
HTT P42858 1/20 0.42
MAPT P10636 1/20 0.42
KMT2A Q03164 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
SCHEMBL7919317 0.89 TBXAS1 (0.54) SMN1; SMN2ALDH1A1CYP2C9TSHRHSD17B10
SCHEMBL7919288 0.84 ALDH1A1 (0.66) SMN1; SMN2ALDH1A1CYP2C9CYP2C19LMNA
SCHEMBL7918958 0.83 ALDH1A1 (0.65) SMN1; SMN2ALDH1A1CYP2C9CYP2C19LMNA
SCHEMBL7918861 0.82 ALDH1A1 (0.63) SMN1; SMN2ALDH1A1CYP2C9CYP2C19LMNA
SCHEMBL7911909 0.82 ALDH1A1 (0.63) SMN1; SMN2ALDH1A1CYP2C9CYP2C19LMNA
SCHEMBL7919345 0.81 ALDH1A1 (0.59) SMN1; SMN2ALDH1A1CYP2C9CYP2C19LMNA
SCHEMBL7918968 0.79 ALDH1A1 (0.60) SMN1; SMN2ALDH1A1CYP2C9CYP2C19LMNA
SCHEMBL7921023 0.79 ALDH1A1 (0.60) SMN1; SMN2ALDH1A1CYP2C9CYP2C19LMNA
SCHEMBL7924015 0.79 ALDH1A1 (0.68) SMN1; SMN2ALDH1A1CYP2C9CYP2C19LMNA
SCHEMBL7920576 0.78 ALDH1A1 (0.52) SMN1; SMN2ALDH1A1CYP2C9CYP2C19LMNA

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