SCHEMBL9740438

SCHEMBL9740438

NC(=O)c1[nH]c(C(=O)O)cc(=O)c1O

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BLM P54132 3/20 0.45
ALOX15 P16050 2/20 0.45
NFKB1 P19838 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
KDM4E B2RXH2 3/20 0.42
TDP1 Q9NUW8 2/20 0.42
NGFR P08138 1/20 0.42
MEN1 O00255 3/20 0.42
HPGD P15428 3/20 0.42
KMT2A Q03164 3/20 0.42
GPR35 Q9HC97 2/20 0.42
ALDH1A1 P00352 2/20 0.42
GRIN2D O15399 2/20 0.42
GRIN3B O60391 2/20 0.42
CYP1A2 P05177 2/20 0.42
MAPK1 P28482 2/20 0.42
CYP2C19 P33261 2/20 0.42
GRIN1 Q05586 2/20 0.42
GRIN2A Q12879 2/20 0.42
GRIN2B Q13224 2/20 0.42

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
SCHEMBL9741078 0.86 ALOX15 (0.50) BLMALOX15NFKB1SMN1; SMN2KDM4E
SCHEMBL9745897 0.81 KDM4E (0.41) BLMKDM4ETDP1MEN1KMT2A
SCHEMBL9744469 0.81 BLM (0.41) BLMALOX15NFKB1SMN1; SMN2KDM4E
Potassium Ion SCHEMBL9741462 0.78 PLA2G7 (0.31)
SCHEMBL9740597 0.70 BLM (0.45) BLMALOX15NFKB1SMN1; SMN2KDM4E
SCHEMBL9741107 0.69 GPR35 (0.45) BLMALOX15NFKB1SMN1; SMN2KDM4E
SCHEMBL9741440 0.69 BLM (0.44) BLMALOX15NFKB1SMN1; SMN2KDM4E
SCHEMBL436330 0.67 NFKB1 (0.50) BLMALOX15NFKB1SMN1; SMN2KDM4E
SCHEMBL11883433 0.66 GPR35 (0.61) BLMALOX15NFKB1SMN1; SMN2KDM4E
SCHEMBL19349224 0.65 GPR35 (0.41) GPR35

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
US-5112968-A Monobactam hydrazide derivatives E. R. SQUIBB & SONS, INC. (US) 1992-05-12 US disclosed