SCHEMBL19977031

SCHEMBL19977031

Cc1ccc(Cl)cc1NC(=O)C(C)NC(=O)c1ccccc1F

nearest known ligand 0.54

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
KCNMA1 Q12791 2/20 0.54
LMNA P02545 4/20 0.52
MEN1 O00255 4/20 0.52
KMT2A Q03164 4/20 0.52
NPSR1 Q6W5P4 3/20 0.48
L3MBTL1 Q9Y468 1/20 0.48
MAPT P10636 4/20 0.48
POLB P06746 2/20 0.48
KDM4E B2RXH2 2/20 0.48
RAB9A P51151 2/20 0.48
NPC1 O15118 1/20 0.48
NPY1R P25929 1/20 0.48
HTT P42858 1/20 0.48
NPY2R P49146 1/20 0.48
ALDH1A1 P00352 3/20 0.47
GAA P10253 3/20 0.45
SMN1; SMN2 Q16637 2/20 0.45
GRIK1 P39086 1/20 0.44
GBA1 P04062 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
SCHEMBL19976968 0.89 KCNMA1 (0.57) KCNMA1LMNAMEN1KMT2ANPSR1
SCHEMBL19976911 0.88 LMNA (0.54) KCNMA1LMNAMEN1KMT2ANPSR1
SCHEMBL19976943 0.88 KMT2A (0.48) LMNAMEN1KMT2AMAPTPOLB
SCHEMBL19977067 0.85 CRHBP (0.60) KCNMA1LMNAMEN1KMT2ANPSR1
SCHEMBL19976906 0.85 PGR (0.52) LMNAMEN1KMT2ANPSR1MAPT
SCHEMBL19976953 0.83 LMNA (0.56) KCNMA1LMNAMEN1KMT2ANPSR1
SCHEMBL16999807 0.83 PSMB5 (0.56) KCNMA1LMNANPSR1L3MBTL1
SCHEMBL16999829 0.83 PSMB5 (0.56) KCNMA1LMNANPSR1L3MBTL1
SCHEMBL16993918 0.83 PSMB5 (0.56) KCNMA1LMNANPSR1L3MBTL1
SCHEMBL16999332 0.83 PSMB5 (0.56) KCNMA1LMNANPSR1L3MBTL1

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