SCHEMBL13749029

SCHEMBL13749029

Bc1cc(CO)nc(NS(=O)(=O)c2ccc(C)cc2)c1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 3/20 0.49
▸ LMNA P02545 2/20 0.49
▸ GAA P10253 2/20 0.49
▸ ALDH1A1 P00352 1/20 0.49
▸ PKM P14618 1/20 0.49
▸ HSD11B1 P28845 2/20 0.45
▸ CYTH2 Q99418 1/20 0.43
▸ FFAR4 Q5NUL3 1/20 0.43
▸ POLB P06746 2/20 0.43
▸ MAPT P10636 2/20 0.43
▸ SMN1; SMN2 Q16637 2/20 0.43
▸ MEN1 O00255 1/20 0.43
▸ RECQL P46063 1/20 0.43
▸ BLM P54132 1/20 0.43
▸ KMT2A Q03164 1/20 0.43
▸ TDP1 Q9NUW8 1/20 0.43
▸ PDE4A P27815 1/20 0.42
▸ AGO2 Q9UKV8 1/20 0.42
▸ HTT P42858 1/20 0.42
▸ HSD17B10 Q99714 1/20 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
SCHEMBL13633458 0.84 KDM4E (0.49) KDM4ELMNAGAAALDH1A1PKM
SCHEMBL13749526 0.82 ALDH1A1 (0.44) KDM4ELMNAGAAALDH1A1PKM
SCHEMBL13749459 0.79 KDM4E (0.49) KDM4ELMNAGAAALDH1A1PKM
SCHEMBL13789387 0.72 KDM4E (0.50) KDM4ELMNAGAAALDH1A1PKM
SCHEMBL14908004 0.69 KDM4E (0.68) KDM4ELMNAGAAALDH1A1PKM
SCHEMBL19911645 0.68 HTR6 (0.70) KDM4ELMNAALDH1A1POLBMAPT
SCHEMBL7836254 0.68 HTR6 (0.76) KDM4ELMNAGAAALDH1A1PKM
SCHEMBL12903578 0.67 SMN1; SMN2 (0.76) KDM4ELMNAGAAALDH1A1PKM
SCHEMBL28722730 0.67 CA12 (0.56) LMNAGAAALDH1A1CYTH2FFAR4
SCHEMBL26053720 0.67 TDP1 (0.70) LMNAALDH1A1POLBMAPTMEN1

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-1737459-B1 IMIDAZOPYRIDINE AND IMIDAZOPYRIMIDINE DERIVATIVES AS ANTIBACTERIAL AGENTS WARNER LAMBERT CO (US) 2009-08-05 — — EP disclosed
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