SCHEMBL9525818

SCHEMBL9525818

CC1=NN(c2ccc(Cl)cc2)C(=O)C1=CNc1ccccc1F

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.55
KMT2A Q03164 3/20 0.55
L3MBTL1 Q9Y468 2/20 0.55
AMY1A P0DUB6 14/20 0.52
ALDH1A1 P00352 3/20 0.47
MAPT P10636 2/20 0.47
TDP1 Q9NUW8 2/20 0.47
LMNA P02545 1/20 0.47
POLB P06746 1/20 0.47
THRB P10828 1/20 0.47
RAB9A P51151 1/20 0.47
GALK1 P51570 1/20 0.47
BLM P54132 1/20 0.47
MCL1 Q07820 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.45
KDM4E B2RXH2 1/20 0.44
MAPK1 P28482 1/20 0.44
HTT P42858 1/20 0.44
HPGD P15428 1/20 0.44
HSD17B10 Q99714 1/20 0.44

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
SCHEMBL6951498 0.85 L3MBTL1 (0.54) MEN1KMT2AL3MBTL1AMY1AALDH1A1
SCHEMBL6951495 0.85 L3MBTL1 (0.54) MEN1KMT2AL3MBTL1AMY1AALDH1A1
SCHEMBL9525542 0.84 KMT2A (0.64) MEN1KMT2AL3MBTL1AMY1AALDH1A1
SCHEMBL9818009 0.82 AMY1A (0.58) MEN1KMT2AL3MBTL1AMY1AALDH1A1
SCHEMBL8425246 0.81 L3MBTL1 (0.49) MEN1KMT2AL3MBTL1AMY1AALDH1A1
SCHEMBL8425249 0.81 L3MBTL1 (0.49) MEN1KMT2AL3MBTL1AMY1AALDH1A1
SCHEMBL6947863 0.78 KDM4E (0.57) MEN1KMT2AL3MBTL1ALDH1A1MAPT
SCHEMBL11244851 0.77 AMY1A (0.59) MEN1KMT2AL3MBTL1AMY1AALDH1A1
SCHEMBL9524221 0.75 KMT2A (0.60) MEN1KMT2AL3MBTL1ALDH1A1MAPT
SCHEMBL9524224 0.75 KMT2A (0.60) MEN1KMT2AL3MBTL1ALDH1A1MAPT

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-0274642-B1 HERBICIDAL AND FUNGICIDAL AGENTS BASED ON SUBSTITUTED PYRAZOLIN-5-ONE DERIVATIVES BAYER AG (DE) 1993-08-11 EP claimed