SCHEMBL4624547

SCHEMBL4624547

Cn1cnc2c(=O)[nH]c(=O)n(Cc3ccccc3)c21

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BRD4 O60885 1/20 0.52
PNP P00491 3/20 0.50
KMT2A Q03164 4/20 0.48
MEN1 O00255 3/20 0.48
KDM4E B2RXH2 5/20 0.47
HTT P42858 2/20 0.47
POLB P06746 2/20 0.47
CXCL8 P10145 2/20 0.47
NOD2 Q9HC29 2/20 0.47
NOD1 Q9Y239 2/20 0.47
TNF P01375 1/20 0.47
MAPT P10636 1/20 0.47
G6PD P11413 1/20 0.47
RAB9A P51151 1/20 0.47
PAX8 Q06710 1/20 0.47
TLR9 Q9NR96 1/20 0.47
HPGD P15428 4/20 0.47
ALDH1A1 P00352 1/20 0.47
BRAF P15056 1/20 0.46
PSMD14 O00487 1/20 0.46

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
SCHEMBL27501339 0.80 BRD4 (0.58) BRD4PNPKMT2AMEN1KDM4E
SCHEMBL23974903 0.79 PDE1A (0.49) KMT2AKDM4EPOLBHPGDALDH1A1
SCHEMBL9328835 0.79 BRD4 (0.72) BRD4PNPKMT2AMEN1KDM4E
SCHEMBL190991 0.78 ALDH1A1 (0.53) BRD4KMT2AMEN1KDM4EMAPT
SCHEMBL5647 0.78 ADORA2A (0.43) KMT2AMEN1KDM4EHPGDALDH1A1
SCHEMBL3115743 0.78 ALDH1A1 (0.51) BRD4PNPKMT2AMEN1KDM4E
SCHEMBL4623646 0.77 ADORA2B (0.45) KMT2AMEN1POLBNOD2NOD1
SCHEMBL4621732 0.77 ADORA2A (0.43) KMT2AMEN1KDM4EHTTMAPT
SCHEMBL3110932 0.77 PDE1A (0.53) BRD4PNPKMT2AMEN1HPGD
SCHEMBL23974900 0.76 ADORA3 (0.52) KMT2AMEN1POLBMAPTHPGD

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