SCHEMBL2358771

SCHEMBL2358771

C=CC(O)NC(CS)C(=O)O

nearest known ligand 0.44

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.44
MAPT P10636 1/20 0.44
THRB P10828 1/20 0.44
ALOX15 P16050 1/20 0.44
NFKB1 P19838 1/20 0.44
PTGS2 P35354 1/20 0.44
THPO P40225 1/20 0.44
RECQL P46063 1/20 0.44
BLM P54132 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
ACE P12821 1/20 0.40
FOLH1 Q04609 1/20 0.38
ENPEP Q07075 1/20 0.32
PTGS1 P23219 1/20 0.32
SLC7A11 Q9UPY5 1/20 0.32
CA1 P00915 1/20 0.31
CA2 P00918 1/20 0.31
TGFBR1 P36897 1/20 0.31

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
SCHEMBL9334528 1.00 KDM4E (0.44) KDM4EMAPTTHRBALOX15NFKB1
SCHEMBL11466995 0.80 TGFBR1 (0.32) KDM4EMAPTTHRBALOX15NFKB1
SCHEMBL9410682 0.80 KDM4E (0.44) KDM4EMAPTTHRBALOX15NFKB1
SCHEMBL1023967 0.78 KDM4E (0.42) KDM4EMAPTTHRBALOX15NFKB1
SCHEMBL20154874 0.77 FOLH1 (0.50) NFKB1BLMFOLH1
SCHEMBL757317 0.77 ECE1 (0.40) KDM4EMAPTCA1CA2TGFBR1
SCHEMBL10355085 0.77 FOLH1 (0.50) NFKB1BLMFOLH1
SCHEMBL759008 0.74 KMT2A (0.41) ALOX15NFKB1BLMFOLH1CA1
SCHEMBL1843782 0.74 KMT2A (0.41) ALOX15NFKB1BLMFOLH1CA1
SCHEMBL3075730 0.74 KDM4E (0.39) KDM4EMAPTTHRBALOX15NFKB1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0346883-B1 Expectorant comprising hydroxy-alkylcysteine derivative SS PHARMACEUTICAL CO (JP) 1994-05-18 EP claimed
EP-0346882-B1 HYDROXYALKYLCYSTEINE DERIVATIVE AND EXPECTORANT CONTAINING THE SAME SS PHARMACEUTICAL CO., LTD. (JP) 1993-09-29 EP claimed
US-5047428-A Side effect reduction SS PHARMACEUTICAL CO., LTD. (JP) 1991-09-10 US claimed
US-4906665-A Hydroxyalkylcysteine derivative and expectorant containing the same SS PHARMACEUTICAL CO., LTD. (JP) 1990-03-06 US claimed
EP-0346883-A2 Expectorant comprising hydroxy-alkylcysteine derivative SS PHARMACEUTICAL CO., LTD. (JP) 1989-12-20 EP claimed
EP-0346882-A2 Hydroxyalkylcysteine derivative and expectorant containing the same SS PHARMACEUTICAL CO., LTD. (JP) 1989-12-20 EP claimed
JP-2003674-A None JP disclosed
EP-1391202-B1 LIQUID DRUG PREPARATIONS HISAMITSU PHARMACEUTICAL CO (JP) 2011-08-03 EP disclosed
JP-2005126352-A DIARRHEA REMEDY MITSUBISHI PHARMA CORP 2005-05-19 JP disclosed
EP-0998926-B1 Oral preparation comprising S-(3-hydroxypropyl)-L-cysteine SSP CO LTD (JP) 2003-04-02 EP disclosed
EP-0346883-B1 Expectorant comprising hydroxy-alkylcysteine derivative SS PHARMACEUTICAL CO (JP) 1994-05-18 EP disclosed
EP-0346882-B1 HYDROXYALKYLCYSTEINE DERIVATIVE AND EXPECTORANT CONTAINING THE SAME SS PHARMACEUTICAL CO., LTD. (JP) 1993-09-29 EP disclosed
US-5047428-A Side effect reduction SS PHARMACEUTICAL CO., LTD. (JP) 1991-09-10 US disclosed
US-4906665-A Hydroxyalkylcysteine derivative and expectorant containing the same SS PHARMACEUTICAL CO., LTD. (JP) 1990-03-06 US disclosed
JP-H023674-A HYDROXYALKYLCYSTEINE DERIVATIVE AND EXPECTORANT CONTAINING THE SAME DERIVATIVE SS PHARMACEUT CO LTD 1990-01-09 JP disclosed
EP-0346882-A2 Hydroxyalkylcysteine derivative and expectorant containing the same SS PHARMACEUTICAL CO., LTD. (JP) 1989-12-20 EP disclosed
EP-0346883-A2 Expectorant comprising hydroxy-alkylcysteine derivative SS PHARMACEUTICAL CO., LTD. (JP) 1989-12-20 EP disclosed
EP-0346882-A2 Hydroxyalkylcysteine derivative and expectorant containing the same SS PHARMACEUTICAL CO., LTD. (JP) 1989-12-20 EP disclosed
EP-0346883-A2 Expectorant comprising hydroxy-alkylcysteine derivative SS PHARMACEUTICAL CO., LTD. (JP) 1989-12-20 EP disclosed
EP-0346882-A2 Hydroxyalkylcysteine derivative and expectorant containing the same SS PHARMACEUTICAL CO., LTD. (JP) 1989-12-20 EP disclosed