SCHEMBL9852497

SCHEMBL9852497

COC(=O)Oc1ncsc1S

nearest known ligand 0.34

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.34
HPGD P15428 2/20 0.34
HSD17B10 Q99714 2/20 0.34
ALDH1A1 P00352 1/20 0.34
MAPT P10636 1/20 0.34
ALOX15 P16050 1/20 0.34
PKM P14618 1/20 0.32
HSD11B1 P28845 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
SCHEMBL10872720 0.80 KDM4E (0.36) KDM4EHPGDHSD17B10ALDH1A1MAPT
SCHEMBL9852576 0.79 KDM4E (0.34) KDM4EPKM
SCHEMBL9627220 0.70 NPSR1 (0.45) KDM4EHPGDHSD17B10ALDH1A1MAPT
SCHEMBL9749147 0.70 MAPK1 (0.40) HPGDHSD17B10ALDH1A1MAPTALOX15
SCHEMBL9852546 0.68 PTGS1 (0.36) HPGDHSD17B10ALDH1A1MAPT
SCHEMBL13969630 0.65 KDM4E (0.35) KDM4EHPGDHSD17B10ALDH1A1MAPT
SCHEMBL2636627 0.64 KDM4E (0.34) KDM4EHPGDHSD17B10ALDH1A1MAPT
SCHEMBL4760779 0.63 KDM4E (0.33) KDM4EHPGDHSD17B10ALDH1A1MAPT
SCHEMBL4632562 0.63 PRKCI (0.38) KDM4EHPGDHSD17B10ALDH1A1MAPT
SCHEMBL15737336 0.63 KDM4E (0.41) KDM4EHPGDHSD17B10ALDH1A1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0409055-A1 Cephalosporin derivatives and processes for their preparation HOECHST AKTIENGESELLSCHAFT (DE) 1991-01-23 EP disclosed