SCHEMBL19977072

SCHEMBL19977072

Cc1c(NC(=O)C(C)NC(=O)c2ccccc2)cccc1C(C)C

nearest known ligand 0.54

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.54
KMT2A Q03164 1/20 0.54
SMN1; SMN2 Q16637 2/20 0.46
POLB P06746 2/20 0.44
GAA P10253 1/20 0.44
HTT P42858 1/20 0.44
HPGD P15428 1/20 0.43
GFER P55789 1/20 0.43
GPR139 Q6DWJ6 2/20 0.42
KCNK3 O14649 1/20 0.41
KCNK9 Q9NPC2 1/20 0.41

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
SCHEMBL19977071 0.90 LMNA (0.45) LMNAKMT2ASMN1; SMN2POLBHTT
SCHEMBL19976955 0.86 POLB (0.53) LMNASMN1; SMN2POLBGAAHTT
SCHEMBL10211579 0.86 KMT2A (0.67) LMNAKMT2APOLBGAAHTT
SCHEMBL19977018 0.84 SMN1; SMN2 (0.50) LMNAKMT2ASMN1; SMN2POLBGAA
SCHEMBL16999513 0.83 USP30 (0.58)
SCHEMBL19977070 0.83 KCNK3 (0.48) LMNASMN1; SMN2POLBGAAHPGD
SCHEMBL19976970 0.82 NPC1 (0.53) LMNAKMT2ASMN1; SMN2HTTHPGD
SCHEMBL19976922 0.82 HPGD (0.66) LMNASMN1; SMN2POLBGAAHTT
SCHEMBL19976977 0.81 SMN1; SMN2 (0.48) LMNAKMT2ASMN1; SMN2POLBHPGD
SCHEMBL19976979 0.81 TAS2R14 (0.50) LMNASMN1; SMN2POLBKCNK3KCNK9

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