SCHEMBL7397108

SCHEMBL7397108

CC(NCC(N)=O)c1ccccc1NCc1ccccc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.48
HSD17B10 Q99714 2/20 0.43
ALDH1A1 P00352 2/20 0.41
MAPT P10636 2/20 0.41
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
HIF1A Q16665 1/20 0.41
HPGD P15428 2/20 0.40
L3MBTL1 Q9Y468 2/20 0.40
CTDSP1 Q9GZU7 1/20 0.40
CD38 P28907 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
CDC7 O00311 1/20 0.39
ROCK2 O75116 1/20 0.39
MAP4K4 O95819 1/20 0.39
GSK3B P49841 1/20 0.39
CLK4 Q9HAZ1 1/20 0.39
MKNK2 Q9HBH9 1/20 0.39
RPS6KB1 P23443 1/20 0.39
HDAC1 Q13547 1/20 0.39

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
SCHEMBL8935356 0.77 HSD17B10 (0.44) POLBHSD17B10ALDH1A1MAPTMEN1
SCHEMBL10490374 0.75 HSD17B10 (0.50) POLBHSD17B10ALDH1A1MAPTMEN1
SCHEMBL12859084 0.74 HSD17B10 (0.53) POLBHSD17B10MAPTHPGDL3MBTL1
SCHEMBL1881711 0.73 APAF1 (0.59) POLBHSD17B10ALDH1A1MAPTMEN1
SCHEMBL1881712 0.73 APAF1 (0.59) POLBHSD17B10ALDH1A1MAPTMEN1
SCHEMBL8935345 0.71 ACACB (0.50) ALDH1A1MAPTMEN1KMT2AHPGD
SCHEMBL14686239 0.71 HSD17B10 (0.50) POLBHSD17B10ALDH1A1MAPTMEN1
SCHEMBL7382915 0.70 CXCL8 (0.49) POLBHSD17B10ALDH1A1MAPTMEN1
SCHEMBL28864994 0.70 HSD17B10 (0.49) POLBHSD17B10ALDH1A1MAPTMEN1
SCHEMBL28308274 0.70 NPC1 (0.59)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5391577-A Active on central nervous system; antiepileptic agents FARMITALIA CARLO ERBA S R L (IT) 1995-02-21 US disclosed
EP-0400495-B1 N-phenylalkyl substituted alpha-amino carboxamide derivatives and process for their preparation. ERBA CARLO SPA (IT) 1993-11-03 EP disclosed
US-5236957-A Antiepileptic agents FARMITALIA CARLO ERBA SRL (IT) 1993-08-17 US disclosed
EP-0426816-A1 N-PHENYLALKYL SUBSTITUTED $g(a)-AMINO CARBOXAMIDE DERIVATIVES AND PROCESS FOR THEIR PREPARATION FARMITALIA CARLO ERBA S.r.l. (IT) 1991-05-15 EP disclosed
EP-0400495-A1 N-phenylalkyl substituted alfa-amino carboxamide derivatives and process for their preparation FARMITALIA CARLO ERBA S.r.l. (IT) 1990-12-05 EP disclosed
WO-1990014334-A1 N-PHENYLALKYL SUBSTITUTED α-AMINO CARBOXAMIDE DERIVATIVES AND PROCESS FOR THEIR PREPARATION FARMITALIA CARLO ERBA S.R.L. (IT) 1990-11-29 WO disclosed