SCHEMBL9155669

SCHEMBL9155669

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

nearest known ligand 0.82

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CASR P41180 2/20 0.48
RAB9A P51151 8/20 0.46
NPC1 O15118 7/20 0.46
MITF O75030 3/20 0.46
SMN1; SMN2 Q16637 2/20 0.46
PAX8 Q06710 1/20 0.46
KMT2A Q03164 3/20 0.43
MEN1 O00255 2/20 0.43
LMNA P02545 1/20 0.43
MAPK1 P28482 1/20 0.43
HPSE Q9Y251 1/20 0.43
PPIB P23284 1/20 0.42
CBS P35520 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
SCHEMBL9154016 0.94 KMT2A (0.52) RAB9ANPC1SMN1; SMN2KMT2AMEN1
SCHEMBL9156251 0.93 L3MBTL1 (0.47) CASRKMT2AMEN1PPIB
SCHEMBL9159917 0.92 ROCK2 (0.45) CASRKMT2AMEN1PPIB
SCHEMBL9157054 0.92 CASR (0.42) CASRRAB9ANPC1MITFSMN1; SMN2
SCHEMBL9134216 0.91 MEN1 (0.43) CASRRAB9ANPC1MITFSMN1; SMN2
SCHEMBL9134932 0.90 RAB9A (0.55) CASRRAB9ANPC1MITFSMN1; SMN2
SCHEMBL9157277 0.89 CASR (0.43) CASRRAB9ANPC1MITFSMN1; SMN2
SCHEMBL9152359 0.89 CASR (0.44) CASRRAB9ANPC1MITFSMN1; SMN2
SCHEMBL9157333 0.89 KMT2A (0.42) CASRRAB9ANPC1SMN1; SMN2KMT2A
SCHEMBL9159354 0.89 MAPT (0.52) RAB9ANPC1SMN1; SMN2KMT2AMEN1

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