SCHEMBL19977124

SCHEMBL19977124

CC(NC(=O)c1ccccc1)C(=O)Nc1ccccc1F

nearest known ligand 0.62

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.62
LMNA P02545 2/20 0.62
RAB9A P51151 4/20 0.57
NPC1 O15118 2/20 0.57
KMT2A Q03164 3/20 0.56
MEN1 O00255 2/20 0.56
ALDH1A1 P00352 2/20 0.54
GAA P10253 2/20 0.54
MAPT P10636 1/20 0.50

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
SCHEMBL19977018 0.89 SMN1; SMN2 (0.50) SMN1; SMN2LMNARAB9ANPC1KMT2A
SCHEMBL19976922 0.84 HPGD (0.66) SMN1; SMN2LMNARAB9ANPC1ALDH1A1
SCHEMBL19976977 0.83 SMN1; SMN2 (0.48) SMN1; SMN2LMNARAB9AKMT2AMEN1
SCHEMBL19977069 0.81 ALDH1A1 (0.57) SMN1; SMN2LMNARAB9AALDH1A1MAPT
SCHEMBL19976980 0.80 NPC1 (0.66) LMNARAB9ANPC1KMT2AMEN1
SCHEMBL19976955 0.80 POLB (0.53) SMN1; SMN2LMNARAB9ANPC1ALDH1A1
SCHEMBL19976893 0.80 SMN1; SMN2 (0.60) SMN1; SMN2RAB9ANPC1KMT2AMEN1
SCHEMBL19976950 0.80 ALDH1A1 (0.51) SMN1; SMN2LMNARAB9ANPC1KMT2A
SCHEMBL19976892 0.80 SMN1; SMN2 (0.56) SMN1; SMN2LMNARAB9ANPC1KMT2A
SCHEMBL19976971 0.79 HDAC1 (0.53) SMN1; SMN2LMNARAB9ANPC1KMT2A

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