SCHEMBL9156433

SCHEMBL9156433

CN(C(=O)CN(C(=O)CNC(=O)Nc1cccc(C#N)c1)c1ccccc1)c1ccccc1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.46
MEN1 O00255 3/20 0.46
KMT2A Q03164 3/20 0.46
ALDH1A1 P00352 2/20 0.46
SMN1; SMN2 Q16637 3/20 0.46
HSD17B10 Q99714 2/20 0.46
MAPK1 P28482 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
MCHR1 Q99705 1/20 0.46
LMNA P02545 2/20 0.46
KCNJ6 P48051 1/20 0.44
KCNJ5 P48544 1/20 0.44
KCNJ3 P48549 1/20 0.44
ALOX15 P16050 2/20 0.43
HTT P42858 1/20 0.43
CCR3 P51677 2/20 0.43
NPC1 O15118 1/20 0.43
RAB9A P51151 1/20 0.43
HTR2A P28223 1/20 0.42
GAA P10253 1/20 0.42

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
SCHEMBL9155308 0.85 PPIB (0.43) MAPTMEN1KMT2AALDH1A1SMN1; SMN2
SCHEMBL9161964 0.85 KMT2A (0.48) MAPTMEN1KMT2AALDH1A1SMN1; SMN2
SCHEMBL8036090 0.85 GAA (0.41) MAPTKMT2ASMN1; SMN2HSD17B10MAPK1
SCHEMBL9157335 0.84 PPIB (0.50) MAPTMEN1KMT2AALDH1A1SMN1; SMN2
SCHEMBL9155669 0.84 CASR (0.48) MEN1KMT2ASMN1; SMN2MAPK1LMNA
SCHEMBL9154016 0.84 KMT2A (0.52) MAPTMEN1KMT2AALDH1A1SMN1; SMN2
SCHEMBL9156251 0.83 L3MBTL1 (0.47) MEN1KMT2AALDH1A1L3MBTL1GAA
SCHEMBL9155935 0.83 PPIB (0.44) MAPTMEN1KMT2AALDH1A1SMN1; SMN2
SCHEMBL9158010 0.83 PPIB (0.44) MAPTMEN1KMT2AALDH1A1SMN1; SMN2
Hydrochloric Acid SCHEMBL9160292 0.83 PPIB (0.49) MAPTMEN1KMT2AALDH1A1SMN1; SMN2

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-5382590-A Gastrointestinal disorders and nervous system disorders RHONE-POULENC RORER S.A. (FR) 1995-01-17 US disclosed