SCHEMBL8549185

SCHEMBL8549185

COC(=O)CCC(C(=O)c1cccc(OCc2ccccc2)c1)c1ccc(Cl)cc1

nearest known ligand 0.69

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
NR4A2 P43354 3/20 0.54
MAOB P27338 3/20 0.53
MAOA P21397 2/20 0.53
MEN1 O00255 1/20 0.52
KMT2A Q03164 1/20 0.52
SMPD1 P17405 2/20 0.48
PTPN1 P18031 1/20 0.47
MRGPRX4 Q96LA9 1/20 0.46
LTA4H P09960 1/20 0.46
GPR132 Q9UNW8 1/20 0.45
NPC1 O15118 1/20 0.45
ALDH1A1 P00352 1/20 0.45
POLB P06746 1/20 0.45
ALOX12 P18054 1/20 0.45
HTT P42858 1/20 0.45
RAB9A P51151 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
SRD5A2 P31213 1/20 0.45

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
SCHEMBL8543419 0.93 MAOB (0.55) NR4A2MAOBMEN1KMT2ASMPD1
SCHEMBL8546084 0.91 NR4A2 (0.52) NR4A2MAOBMAOAMEN1KMT2A
SCHEMBL8551278 0.91 MAOB (0.52) NR4A2MAOBMEN1KMT2ASMPD1
SCHEMBL8551050 0.90 MAOB (0.48) NR4A2MAOBMAOAMEN1KMT2A
SCHEMBL7907422 0.90 NR4A2 (0.58) NR4A2MAOBMAOAMEN1KMT2A
SCHEMBL7901169 0.90 NR4A2 (0.58) NR4A2MAOBMAOAMEN1KMT2A
SCHEMBL8545953 0.87 MAOB (0.51) NR4A2MAOBMAOAMEN1KMT2A
SCHEMBL8546264 0.87 MAOB (0.51) NR4A2MAOBKMT2ASMPD1PTPN1
SCHEMBL8550294 0.86 MAOB (0.50) NR4A2MAOBMAOAMEN1KMT2A
SCHEMBL8549782 0.85 MAOB (0.53) NR4A2MAOBMAOAMEN1KMT2A

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
EP-0728128-B1 SUBSTITUTED PHENYL COMPOUNDS RHONE POULENC RORER LTD (GB) 1998-09-16 EP claimed