SCHEMBL9361507

SCHEMBL9361507

CC(=O)Oc1cccc(-c2nn[c]s2)c1OC(C)=O

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPK1 P28482 2/20 0.46
▸ PTPN1 P18031 1/20 0.38
▸ KDM4E B2RXH2 7/20 0.37
▸ ALDH1A1 P00352 5/20 0.37
▸ BLM P54132 2/20 0.37
▸ TDP1 Q9NUW8 2/20 0.37
▸ GAA P10253 2/20 0.37
▸ MAPT P10636 2/20 0.37
▸ KMT2A Q03164 2/20 0.37
▸ POLB P06746 1/20 0.37
▸ APEX1 P27695 1/20 0.37
▸ RECQL P46063 1/20 0.37
▸ L3MBTL1 Q9Y468 1/20 0.37
▸ HSD17B10 Q99714 5/20 0.36
▸ HPGD P15428 4/20 0.36
▸ TSHR P16473 2/20 0.36
▸ ESR1 P03372 1/20 0.36
▸ ITGB3 P05106 1/20 0.36
▸ ITGA2B P08514 1/20 0.36
▸ HMGB1 P09429 1/20 0.36

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
SCHEMBL9364766 0.74 MAPK1 (0.50) MAPK1PTPN1KDM4EALDH1A1BLM
SCHEMBL9360360 0.73 MAPK1 (0.49) MAPK1PTPN1KDM4EALDH1A1BLM
SCHEMBL9365438 0.73 MAPK1 (0.46) MAPK1PTPN1KDM4EALDH1A1BLM
SCHEMBL5212814 0.72 MAPK1 (0.71) MAPK1PTPN1KDM4EALDH1A1BLM
SCHEMBL9361057 0.71 MAPK1 (0.44) MAPK1PTPN1KDM4EALDH1A1BLM
SCHEMBL8676657 0.70 MAPK1 (0.60) MAPK1PTPN1KDM4EALDH1A1BLM
SCHEMBL28975051 0.69 MAPK1 (0.47) MAPK1PTPN1KDM4EALDH1A1BLM
SCHEMBL10596845 0.68 MAPK1 (0.57) MAPK1PTPN1KDM4EALDH1A1BLM
SCHEMBL702527 0.68 MAPK1 (0.61) MAPK1PTPN1KDM4EALDH1A1BLM
SCHEMBL6313351 0.68 MPL (0.47) MAPK1PTPN1KDM4EALDH1A1BLM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0241901-B1 Cephalosporin derivatives, processes for their preparation and antibacterial agents BANYU PHARMA CO LTD (JP) 1994-08-24 — — EP disclosed
US-5061794-A Effective against pseudomonads BANYU PHARMACEUTICAL CO., LTD. (JP) 1991-10-29 — — US disclosed
EP-0241901-A2 Cephalosporin derivatives, processes for their preparation and antibacterial agents Banyu Pharmaceutical Co., Ltd. (JP) 1987-10-21 — — EP disclosed
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