SCHEMBL7846764

SCHEMBL7846764

CCc1c(C(=O)c2cc(C)cc(C)c2)[nH]c(=O)n(Cc2cc(OC)cc(OC)c2)c1=O

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 2/20 0.37
TP53 P04637 3/20 0.37
ALDH1A1 P00352 4/20 0.37
MAPT P10636 3/20 0.37
MEN1 O00255 2/20 0.37
KMT2A Q03164 2/20 0.37
KDM4E B2RXH2 1/20 0.36
BACE1 P56817 1/20 0.36
MTNR1A P48039 1/20 0.35
MTNR1B P49286 1/20 0.35
GAA P10253 3/20 0.35
HTT P42858 2/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
TDP1 Q9NUW8 2/20 0.35
USP2 O75604 1/20 0.34
LMNA P02545 1/20 0.34
PKM P14618 1/20 0.34
TSHR P16473 1/20 0.34
CASP1 P29466 1/20 0.34
CASP7 P55210 1/20 0.34

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
SCHEMBL7849696 0.91 HSD17B10 (0.48) HSD17B10TP53ALDH1A1MAPTKMT2A
SCHEMBL7848458 0.85 MAPT (0.36) TP53ALDH1A1MAPTMEN1KMT2A
SCHEMBL7844325 0.85 TYMS (0.35) TP53ALDH1A1MAPTMEN1KMT2A
SCHEMBL7845884 0.85 GRIN1 (0.36) TP53ALDH1A1MAPTMEN1KMT2A
SCHEMBL7848710 0.84 MTNR1A (0.37) HSD17B10TP53ALDH1A1MAPTMEN1
SCHEMBL6086765 0.84 MEN1 (0.38) HSD17B10TP53ALDH1A1MAPTMEN1
SCHEMBL7845229 0.81 TYMS (0.41) TP53ALDH1A1MAPTMEN1KMT2A
SCHEMBL7846211 0.79 MEN1 (0.36) TP53ALDH1A1MAPTMEN1KMT2A
SCHEMBL7848789 0.79 GRIN1 (0.43) HSD17B10ALDH1A1MEN1KMT2AKDM4E
SCHEMBL7837064 0.79 HSD17B10 (0.39) HSD17B10TP53ALDH1A1MAPTMEN1

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-1100786-A1 ANTIVIRAL PYRIMIDINEDIONE DERIVATIVES AND PROCESS FOR THE PREPARATION THEREOF Samjin Pharmaceutical Co., Ltd. (KR) 2001-05-23 EP disclosed
WO-2000061564-A1 ANTIVIRAL PYRIMIDINEDIONE DERIVATIVES AND PROCESS FOR THE PREPARATION THEREOF SAMJIN PHARMACEUTICAL CO., LTD. (KR) 2000-10-19 WO disclosed