SCHEMBL8546901

SCHEMBL8546901

CCOC(=O)CCC(C(=O)c1cc(OCc2ccccc2)cc(OCc2ccc(OC)cc2)c1)c1ccccc1C

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42
LMNA P02545 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
MAOB P27338 2/20 0.41
RAB9A P51151 3/20 0.41
SMN1; SMN2 Q16637 3/20 0.41
NPC1 O15118 2/20 0.41
POLB P06746 1/20 0.41
PPARG P37231 3/20 0.40
PPARD Q03181 3/20 0.40
PPARA Q07869 3/20 0.40
TP53 P04637 1/20 0.40
PKM P14618 1/20 0.40
NFKB1 P19838 1/20 0.40
NFKB2 Q00653 1/20 0.40
RELA Q04206 1/20 0.40
MRGPRX4 Q96LA9 1/20 0.40
RXFP1 Q9HBX9 1/20 0.40
FFAR1 O14842 3/20 0.40

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
SCHEMBL7909072 0.91 FFAR1 (0.47) MEN1KMT2ARAB9ASMN1; SMN2NPC1
SCHEMBL7909065 0.91 FFAR1 (0.47) MEN1KMT2ARAB9ASMN1; SMN2NPC1
SCHEMBL7900943 0.84 MEN1 (0.51) MEN1KMT2AMAOBFFAR1
SCHEMBL7900946 0.84 MEN1 (0.51) MEN1KMT2AMAOBFFAR1
SCHEMBL8547554 0.83 SMPD1 (0.53) LMNAMAOBRAB9ASMN1; SMN2NPC1
SCHEMBL8546902 0.82 PPARA (0.47) MEN1KMT2AMAOBRAB9ASMN1; SMN2
SCHEMBL7907471 0.82 SMPD1 (0.52) MAOBFFAR1SMPD1
SCHEMBL7907467 0.82 SMPD1 (0.52) MAOBFFAR1SMPD1
SCHEMBL8545508 0.81 MAOB (0.52) MEN1KMT2AMAOBSMPD1
SCHEMBL8545812 0.80 MAOB (0.51) MEN1KMT2AMAOBNR1H4SMPD1

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