SCHEMBL4624542

SCHEMBL4624542

Cc1nc2c([nH]1)c(=O)[nH]c(=O)n2Cc1ccccc1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PNP P00491 1/20 0.60
TLR7 Q9NYK1 3/20 0.60
KDM4E B2RXH2 6/20 0.59
HPGD P15428 4/20 0.59
KMT2A Q03164 4/20 0.59
TSHR P16473 3/20 0.59
MEN1 O00255 3/20 0.59
HTT P42858 2/20 0.59
PSMD14 O00487 1/20 0.59
ADORA3 P0DMS8 2/20 0.55
ALDH1A1 P00352 4/20 0.55
MAPT P10636 3/20 0.55
GAA P10253 1/20 0.55
HSD17B10 Q99714 2/20 0.53
POLB P06746 2/20 0.53
PKM P14618 2/20 0.53
MCL1 Q07820 2/20 0.53
ADORA2A P29274 2/20 0.52
BRD4 O60885 1/20 0.52
ADORA2B P29275 1/20 0.52

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
SCHEMBL5641835 0.83 PNP (0.60) PNPTLR7KDM4EHPGDKMT2A
SCHEMBL8142359 0.80 MEN1 (0.67) PNPHPGDKMT2ATSHRMEN1
SCHEMBL22560010 0.80 PNP (0.65) PNPTLR7HPGDALDH1A1ADORA2A
SCHEMBL18113975 0.80 PNP (0.56) PNPTLR7KDM4EHPGDKMT2A
SCHEMBL10963141 0.79 ADORA2A (0.55) HPGDKMT2AMEN1HTTADORA3
SCHEMBL8355232 0.77 ADORA3 (0.65) PNPTLR7KDM4EHPGDKMT2A
SCHEMBL4202515 0.77 PNP (0.53) PNPTLR7KDM4EHPGDKMT2A
SCHEMBL4193079 0.76 PNP (0.52) PNPTLR7KDM4EHPGDKMT2A
SCHEMBL9032111 0.75 PNP (1.00) PNPTLR7HPGDKMT2AADORA3
SCHEMBL16206181 0.75 TLR7 (1.00) TLR7ADORA2A

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-1904020-A2 NEW SLIMMING COSMETIC COMPOSITIONS Sederma S.A.S. (FR) 2008-04-02 EP disclosed
WO-2007010478-A2 SLIMMING COSMETIC COMPOSITIONS SEDERMA (FR) 2007-01-25 WO disclosed