SCHEMBL9021900

SCHEMBL9021900

CCc1c(N)nc(=S)n(CC)c1N

nearest known ligand 0.32

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.32
ALDH1A1 P00352 1/20 0.32
POLB P06746 1/20 0.32
GAA P10253 1/20 0.32
HPGD P15428 1/20 0.32
ALOX15 P16050 1/20 0.32
HSD17B10 Q99714 1/20 0.32
ADORA3 P0DMS8 1/20 0.31
ADORA2A P29274 1/20 0.31
ADORA2B P29275 1/20 0.31
ADORA1 P30542 1/20 0.31
CYP1A2 P05177 1/20 0.30
CYP2D6 P10635 1/20 0.30
HTT P42858 1/20 0.30

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
SCHEMBL9409353 0.80 HSD17B10 (0.33) ALDH1A1POLBGAAHPGDALOX15
SCHEMBL9022505 0.78
SCHEMBL9021673 0.78 ALOX15 (0.33) ALDH1A1POLBGAAHPGDALOX15
SCHEMBL9322770 0.65 CYP1A2 (0.40) ALDH1A1POLBGAAHPGDALOX15
SCHEMBL12282579 0.65 ALDH1A1 (0.49) ALDH1A1POLBGAAHPGDALOX15
SCHEMBL7112477 0.63 NOS2 (0.34) SMN1; SMN2ALDH1A1GAAALOX15HSD17B10
SCHEMBL13653845 0.62 HEXA (0.41) SMN1; SMN2ALDH1A1CYP1A2CYP2D6
SCHEMBL12261737 0.61 HTT (0.41) SMN1; SMN2ALDH1A1GAAHPGDALOX15
SCHEMBL9705963 0.59 MAPT (0.31) SMN1; SMN2ALOX15HSD17B10
SCHEMBL9409221 0.58 DHFR (0.32)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0397511-B1 Novel cephalosporin compounds and processes for preparation thereof LUCKY LTD (KR) 1996-09-04 EP disclosed
US-5202315-A Antiboiotic LUCKY, LTD. (KR) 1993-04-13 US disclosed
WO-1992008721-A1 NOVEL CEPHALOSPORIN COMPOUNDS AND PROCESSES FOR PREPARATION THEREOF LUCKY, LTD. (KR) 1992-05-29 WO disclosed
EP-0397511-A2 Novel cephalosporin compounds and processes for preparation thereof LUCKY, LTD. (KR) 1990-11-14 EP disclosed