SCHEMBL8546202

SCHEMBL8546202

CCOC(=O)CCC(Oc1cc(OCc2ccsc2)ccc1C(=O)NCCCn1ccnc1)c1ccccc1C

nearest known ligand 0.56

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 1/20 0.44
KDM4E B2RXH2 1/20 0.44
ALDH1A1 P00352 1/20 0.44
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42
NAMPT P43490 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
SCHEMBL7910790 0.93 MEN1 (0.44) KDM4EALDH1A1MEN1KMT2A
SCHEMBL7910784 0.93 MEN1 (0.44) KDM4EALDH1A1MEN1KMT2A
SCHEMBL8546206 0.88 KDM4E (0.43) MAPK1KDM4EALDH1A1MEN1KMT2A
SCHEMBL8549778 0.86
SCHEMBL8549902 0.83
SCHEMBL8550511 0.81
SCHEMBL8551106 0.80
SCHEMBL7908802 0.79
SCHEMBL7908806 0.79
SCHEMBL8544981 0.79

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-0728128-B1 SUBSTITUTED PHENYL COMPOUNDS RHONE POULENC RORER LTD (GB) 1998-09-16 EP claimed