SCHEMBL8030733

SCHEMBL8030733

Cc1cccc(NC(=O)NCC(=O)N(CC(=O)N(C)c2ccccc2)c2cccc(OCC(=O)N(C)c3cccc(Cl)c3)c2)c1

nearest known ligand 0.74

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.44
KMT2A Q03164 3/20 0.44
POLB P06746 1/20 0.44
MAPK1 P28482 2/20 0.43
ALDH1A1 P00352 3/20 0.39
HTT P42858 1/20 0.39
LMNA P02545 2/20 0.39
TP53 P04637 2/20 0.39
MAPT P10636 1/20 0.39
THRB P10828 1/20 0.39
RXFP1 Q9HBX9 1/20 0.39
BDKRB2 P30411 2/20 0.39
GRM5 P41594 1/20 0.39
HSP90AA1 P07900 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
GAA P10253 1/20 0.38
ALOX12 P18054 1/20 0.38
PYGL P06737 1/20 0.37

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
SCHEMBL8036208 0.94 MEN1 (0.48) MEN1KMT2APOLBMAPK1ALDH1A1
SCHEMBL8034026 0.94 MAPK1 (0.47) MEN1KMT2APOLBMAPK1HTT
SCHEMBL8030236 0.94 MAPK1 (0.48) MEN1KMT2APOLBMAPK1HTT
SCHEMBL8033743 0.92 MAPK1 (0.46) MEN1KMT2APOLBMAPK1HTT
SCHEMBL8036317 0.91 MAPK1 (0.45) MEN1KMT2APOLBMAPK1HTT
SCHEMBL8030567 0.90 MAPK1 (0.43) MEN1KMT2APOLBMAPK1HTT
SCHEMBL8030428 0.90 MAPK1 (0.43) MEN1KMT2APOLBMAPK1ALDH1A1
SCHEMBL8033874 0.90 SMN1; SMN2 (0.43) MEN1KMT2APOLBMAPK1ALDH1A1
SCHEMBL9157309 0.89 MEN1 (0.46) MEN1KMT2AALDH1A1HTTLMNA
SCHEMBL8033768 0.89 MAPK1 (0.45) MEN1KMT2APOLBMAPK1HTT

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-0985660-A1 AMINOPHENOL DERIVATIVES DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2000-03-15 EP disclosed