SCHEMBL19976933

SCHEMBL19976933

CC(NC(=O)c1ccccc1Cl)C(=O)Nc1cccc2ncccc12

nearest known ligand 0.73

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PABPC1 P11940 4/20 0.73
EIF4H Q15056 4/20 0.73
MEN1 O00255 5/20 0.55
KMT2A Q03164 5/20 0.55
ALDH1A1 P00352 3/20 0.55
KDM4E B2RXH2 1/20 0.55
MAPT P10636 1/20 0.54
L3MBTL1 Q9Y468 1/20 0.52
CLK1 P49759 2/20 0.51
KDR P35968 1/20 0.49
LMNA P02545 1/20 0.49
HTT P42858 1/20 0.49
SMN1; SMN2 Q16637 1/20 0.49
POLB P06746 1/20 0.48
HDAC6 Q9UBN7 1/20 0.47

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
SCHEMBL19976939 0.88 ALDH1A1 (0.56) PABPC1EIF4HMEN1KMT2AALDH1A1
SCHEMBL19976908 0.87 ALDH1A1 (0.55) PABPC1EIF4HMEN1KMT2AALDH1A1
SCHEMBL19976894 0.84 ALDH1A1 (0.62) PABPC1EIF4HMEN1KMT2AALDH1A1
SCHEMBL16999319 0.83 PABPC1 (0.66) PABPC1EIF4HMEN1KMT2AALDH1A1
SCHEMBL16993979 0.83 PABPC1 (0.66) PABPC1EIF4HMEN1KMT2AALDH1A1
SCHEMBL19977127 0.80 TRPV1 (0.54) MEN1KMT2ALMNAHTT
SCHEMBL19976946 0.78 ALDH1A1 (0.65) PABPC1EIF4HMEN1KMT2AALDH1A1
SCHEMBL19976910 0.78 PGR (0.52) MEN1KMT2AALDH1A1KDM4EMAPT
SCHEMBL12864492 0.77 MEN1 (0.70) PABPC1EIF4HMEN1KMT2AALDH1A1
SCHEMBL19977030 0.75 MAPT (0.57) MEN1KMT2AALDH1A1KDM4EMAPT

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
US-9919998-B2 Antibacterial agents: Nα-aroyl-N-aryl-phenylalaninamides RUTGERS, THE STATE UNIVERSITY OF NEW JERSEY (US) 2018-03-20 US disclosed