SCHEMBL6573798

SCHEMBL6573798

CNC(=O)[CH]Cc1c[nH]c2ccccc12

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.53
MEN1 O00255 3/20 0.53
KMT2A Q03164 3/20 0.53
GPR84 Q9NQS5 2/20 0.53
CYP3A4 P08684 1/20 0.53
AHR P35869 1/20 0.53
TDP1 Q9NUW8 1/20 0.53
PKM P14618 2/20 0.52
LMNA P02545 1/20 0.52
CYP1A2 P05177 1/20 0.52
TSHR P16473 1/20 0.52
CYP2C19 P33261 1/20 0.52
BLM P54132 1/20 0.52
KDM4E B2RXH2 4/20 0.51
ALDH1A1 P00352 3/20 0.51
SMN1; SMN2 Q16637 2/20 0.51
HTR1A P08908 2/20 0.51
HTR2A P28223 2/20 0.51
HTT P42858 1/20 0.51
APAF1 O14727 1/20 0.50

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
SCHEMBL631077 0.83 MAPT (0.50) MAPTMEN1KMT2AGPR84CYP3A4
SCHEMBL290807 0.82 GPR84 (0.53) MAPTMEN1KMT2AGPR84CYP3A4
SCHEMBL18498486 0.81 MEN1 (0.59) MAPTMEN1KMT2AGPR84CYP3A4
SCHEMBL8850529 0.80 MEN1 (0.61) MAPTMEN1KMT2AKDM4EALDH1A1
SCHEMBL2124899 0.80 MAPT (0.54) MAPTMEN1KMT2AGPR84CYP3A4
SCHEMBL13735764 0.77 POLB (0.50) MAPTMEN1KMT2AGPR84CYP3A4
SCHEMBL1395865 0.77 MAPT (0.62) MAPTMEN1KMT2AGPR84CYP3A4
Indole-3-Acetic Acid SCHEMBL27576118 0.77 MEN1 (0.55) MAPTMEN1KMT2AGPR84CYP3A4
SCHEMBL7621032 0.76 KMT2A (0.48) MAPTKMT2APKMLMNAKDM4E
SCHEMBL7613223 0.76 HDAC3 (0.48) MEN1KMT2ALMNAALDH1A1HTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1409540-A2 MELANOCORTIN RECEPTOR LIGANDS THE PROCTER & GAMBLE COMPANY (US) 2004-04-21 EP disclosed
WO-2002026774-A2 MELANOCORTIN RECEPTOR LIGANDS THE PROCTER & GAMBLE COMPANY (US) 2002-04-04 WO disclosed