SCHEMBL9677293

SCHEMBL9677293

CCOC(=O)c1cc(S)n2ncnc2n1

nearest known ligand 0.49

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.49
L3MBTL1 Q9Y468 2/20 0.49
MEN1 O00255 1/20 0.49
KMT2A Q03164 1/20 0.49
LMNA P02545 3/20 0.45
HPGD P15428 3/20 0.44
KDM4E B2RXH2 1/20 0.44
MAPT P10636 1/20 0.42
CYP1A2 P05177 2/20 0.42
TSHR P16473 1/20 0.42
HTT P42858 1/20 0.42
MAPK1 P28482 3/20 0.39
NPSR1 Q6W5P4 1/20 0.39
HSD17B10 Q99714 1/20 0.39

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
SCHEMBL10165798 0.86 ALDH1A1 (0.51) ALDH1A1L3MBTL1MEN1KMT2ALMNA
SCHEMBL9678491 0.85 ALDH1A1 (0.50) ALDH1A1L3MBTL1MEN1KMT2ALMNA
SCHEMBL9677615 0.84 ALDH1A1 (0.49) ALDH1A1L3MBTL1MEN1KMT2ALMNA
SCHEMBL9679660 0.81 ALDH1A1 (0.48) ALDH1A1L3MBTL1MEN1KMT2AHPGD
SCHEMBL9870038 0.79 L3MBTL1 (0.50) ALDH1A1L3MBTL1MEN1KMT2ALMNA
SCHEMBL9678737 0.78 ALDH1A1 (0.39) ALDH1A1L3MBTL1HPGDKDM4EMAPT
SCHEMBL9679620 0.74 CYP1A2 (0.43) ALDH1A1MEN1KMT2ALMNAHPGD
SCHEMBL9677372 0.73 ALDH1A1 (0.49) ALDH1A1L3MBTL1MEN1KMT2ALMNA
SCHEMBL9679665 0.73 CYP1A2 (0.42) ALDH1A1MEN1KMT2AHPGDKDM4E
SCHEMBL9677299 0.73 KDM4E (0.44) ALDH1A1L3MBTL1MEN1KMT2ALMNA

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-0150507-B1 CEPHALOSPORIN DERIVATIVES, PROCESSES FOR PRODUCING THE SAME AND COMPOSITIONS CONTAINING THEM MOCHIDA PHARMACEUTICAL CO., LTD. (JP) 1992-08-05 EP disclosed
US-5064953-A INTERMEDIATES CEPHALOSPORIN DERIVATIVES MOCHIDA PHARMACEUTICAL CO., LTD. (JP) 1991-11-12 US disclosed
US-4888332-A ANTIBIOTICS MOCHIDA PHARMACEUTICAL CO., LTD. (JP) 1989-12-19 US disclosed