SCHEMBL10701976

SCHEMBL10701976

CNC(C)C(=O)c1ccc(NC(C)=O)cc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.52
L3MBTL1 Q9Y468 2/20 0.52
HTT P42858 1/20 0.52
ALDH1A1 P00352 4/20 0.51
KMT2A Q03164 5/20 0.50
MEN1 O00255 4/20 0.50
MAPT P10636 2/20 0.50
TDP1 Q9NUW8 1/20 0.50
TP53 P04637 1/20 0.50
HIF1A Q16665 1/20 0.50
CACNA1B Q00975 1/20 0.50
APBA1 Q02410 1/20 0.50
CA12 O43570 1/20 0.50
BRD4 O60885 1/20 0.50
NR1I2 O75469 1/20 0.50
CA1 P00915 1/20 0.50
CA2 P00918 1/20 0.50
MB P02144 1/20 0.50
CYP1A1 P04798 1/20 0.50
CA3 P07451 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
Hydrochloric Acid SCHEMBL9596558 0.98 ALDH1A1 (0.50) SMN1; SMN2L3MBTL1HTTALDH1A1KMT2A
SCHEMBL10496940 0.84 CACNA1B (0.53) SMN1; SMN2L3MBTL1HTTALDH1A1KMT2A
SCHEMBL15047897 0.83 SMN1; SMN2 (0.57) SMN1; SMN2L3MBTL1HTTALDH1A1KMT2A
Hydrochloric Acid SCHEMBL9596329 0.83 CACNA1B (0.51) SMN1; SMN2L3MBTL1HTTALDH1A1KMT2A
SCHEMBL11235456 0.81 SMN1; SMN2 (0.55) SMN1; SMN2L3MBTL1HTTALDH1A1KMT2A
SCHEMBL10496871 0.81 ALDH1A1 (0.50) SMN1; SMN2L3MBTL1HTTALDH1A1KMT2A
SCHEMBL10497023 0.81 SLC6A3 (0.55) SMN1; SMN2L3MBTL1HTTALDH1A1KMT2A
Hydrochloric Acid SCHEMBL10390651 0.80 MEN1 (0.49) SMN1; SMN2L3MBTL1HTTALDH1A1KMT2A
SCHEMBL10815283 0.80 SMN1; SMN2 (0.53) SMN1; SMN2L3MBTL1HTTALDH1A1KMT2A
SCHEMBL9821071 0.80 SMN1; SMN2 (0.53) SMN1; SMN2L3MBTL1HTTALDH1A1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0174242-B1 1-(AMINO-PHENYL)-2-AMINO PROPANON DERIVATIVES, THEIR USE IN THERAPY AND PROCESS FOR THEIR PREPARATION LABORATOIRE L. LAFON Société anonyme dite: (FR) 1988-01-13 EP disclosed
EP-0174242-A2 1-(Amino-phenyl)-2-amino propanon derivatives, their use in therapy and process for their preparation LABORATOIRE L. LAFON Société anonyme dite: (FR) 1986-03-12 EP disclosed