SCHEMBL7846642

SCHEMBL7846642

CCc1c(Oc2cc(C)cc(C)c2)[nH]c(=O)n(Cc2cccc(Cl)n2)c1=O

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TLR7 Q9NYK1 1/20 0.33
NPC1 O15118 1/20 0.32
RAB9A P51151 1/20 0.32
P2RX3 P56373 4/20 0.32
DDR1 Q08345 1/20 0.32
GRIN1 Q05586 3/20 0.32
GRIN2B Q13224 3/20 0.32
MEN1 O00255 2/20 0.32
KMT2A Q03164 2/20 0.32
HTT P42858 1/20 0.32
RECQL P46063 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32
MAPT P10636 2/20 0.31
NOX4 Q9NPH5 1/20 0.31
KDM4E B2RXH2 2/20 0.31
ALDH1A1 P00352 2/20 0.31
DRD1 P21728 1/20 0.31
RGS12 O14924 1/20 0.31
USP2 O75604 1/20 0.31
POLB P06746 1/20 0.31

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
SCHEMBL7847089 0.88 POLB (0.33) TLR7NPC1RAB9ADDR1GRIN1
SCHEMBL7849498 0.85 TLR7 (0.33) TLR7P2RX3MEN1KMT2ANPSR1
SCHEMBL6087138 0.84 DRD1 (0.36) TLR7MEN1KMT2AHTTRECQL
SCHEMBL8189652 0.83 KDM4E (0.45) TLR7P2RX3MEN1KMT2AHTT
SCHEMBL7848188 0.80 TLR7 (0.33) TLR7NPC1RAB9ADDR1GRIN1
SCHEMBL7847258 0.79 ALDH1A1 (0.34) RAB9AP2RX3DDR1GRIN1GRIN2B
SCHEMBL7847583 0.79 TLR7 (0.32) TLR7NPC1RAB9AMEN1KMT2A
SCHEMBL7836586 0.78 HSD17B10 (0.51) GRIN1GRIN2BMEN1KMT2AMAPT
SCHEMBL7847304 0.78 GRIN1 (0.44) GRIN1GRIN2BMEN1KMT2ANOX4
SCHEMBL7848837 0.76 TP53 (0.39) NPC1RAB9AMEN1KMT2AMAPT

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