SCHEMBL8784255

SCHEMBL8784255

COC(=O)c1ccc(Cl)cc1NC(=O)Cc1cccc(N)c1

nearest known ligand 0.54

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 6/20 0.54
KMT2A Q03164 6/20 0.54
POLB P06746 1/20 0.53
ABL1 P00519 1/20 0.49
MAPT P10636 2/20 0.47
LMNA P02545 1/20 0.47
KCNQ2 O43526 4/20 0.47
L3MBTL1 Q9Y468 2/20 0.47
SMN1; SMN2 Q16637 2/20 0.45
ALDH1A1 P00352 2/20 0.45
KDM4E B2RXH2 1/20 0.45
DNMT1 P26358 1/20 0.45
MAPK1 P28482 1/20 0.45
MAPK8 P45983 1/20 0.44
HPGD P15428 1/20 0.43

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
SCHEMBL8784047 0.86 MEN1 (0.54) MEN1KMT2APOLBMAPTLMNA
SCHEMBL8783960 0.86 MEN1 (0.54) MEN1KMT2APOLBMAPTLMNA
SCHEMBL8785078 0.86 MEN1 (0.63) MEN1KMT2APOLBMAPTLMNA
SCHEMBL9098209 0.84 MEN1 (0.52) MEN1KMT2APOLBMAPTLMNA
SCHEMBL8784073 0.83 KMT2A (0.56) MEN1KMT2APOLBMAPTLMNA
SCHEMBL8153325 0.83 MEN1 (0.58) MEN1KMT2APOLBABL1MAPT
SCHEMBL8785479 0.82 POLB (0.54) MEN1KMT2APOLBMAPTLMNA
SCHEMBL8785627 0.82 MEN1 (0.50) MEN1KMT2APOLBMAPTLMNA
SCHEMBL8784013 0.82 L3MBTL1 (0.60) MEN1KMT2APOLBMAPTLMNA
SCHEMBL9098202 0.82 MEN1 (0.50) MEN1KMT2APOLBMAPTLMNA

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0481676-B1 Hydroxyquinolone derivatives MERCK SHARP & DOHME (GB) 1997-01-29 EP disclosed
US-5559125-A NMDA AND AMPA RECEPTOR ANTAGONISTS, SCHIZOPHRENIA MERCK, SHARP & DOHME LIMITED (GB) 1996-09-24 US disclosed
US-5348962-A Nervous system disorders; schizophrenia MERCK SHARPE & DOHME LTD. 1994-09-20 US disclosed
EP-0481676-A1 Hydroxyquinolone derivatives MERCK SHARP & DOHME LTD. (GB) 1992-04-22 EP disclosed