SCHEMBL7562973

SCHEMBL7562973

CON=C(C(=O)O)c1nc(NC(c2ccccc2)(c2ccccc2)c2ccccc2)sc1Cl

nearest known ligand 0.37

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
GAA P10253 2/20 0.37
LMNA P02545 1/20 0.37
MAPT P10636 1/20 0.37
KCNN4 O15554 1/20 0.35
MEN1 O00255 1/20 0.31
OPRM1 P35372 1/20 0.31
OPRD1 P41143 1/20 0.31
KMT2A Q03164 1/20 0.31
HPGD P15428 2/20 0.30
KDM4E B2RXH2 1/20 0.30
ALDH1A1 P00352 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30
HSD17B10 Q99714 1/20 0.30
NPC1 O15118 1/20 0.30
RAB9A P51151 1/20 0.30
ALOX5 P09917 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
SCHEMBL7562967 1.00 GAA (0.37) GAALMNAMAPTKCNN4MEN1
SCHEMBL2454809 0.88
SCHEMBL2454811 0.88
SCHEMBL3237998 0.88
SCHEMBL11376524 0.87 MEN1 (0.39) GAALMNAMAPTKCNN4MEN1
SCHEMBL11373714 0.87 MEN1 (0.39) GAALMNAMAPTKCNN4MEN1
SCHEMBL10680217 0.86 MEN1 (0.39) GAALMNAMAPTKCNN4MEN1
SCHEMBL10680222 0.86 MEN1 (0.39) GAALMNAMAPTKCNN4MEN1
SCHEMBL11370841 0.84 MEN1 (0.38) GAALMNAMAPTMEN1KMT2A
SCHEMBL1686728 0.80 ALDH1A1 (0.33) LMNAMAPTKCNN4MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1077981-B1 NOVEL CEPHALOSPORIN COMPOUNDS, PROCESSES FOR PREPARATION THEREOF AND ANTIMICROBIAL COMPOSITIONS CONTAINING THE SAME LG CHEMICAL LTD (KR) 2002-08-07 EP disclosed
CN-1300290-A Novel cephalosporin compounds, process for their preparation and antibacterial compositions containing them LG CHEMICAL LTD (KR) 2001-06-20 CN disclosed