SCHEMBL6087014

SCHEMBL6087014

CCc1c(Oc2cc(C)cc(C)c2)n(Cc2ccc3ccccc3c2)c(=O)[nH]c1=O

nearest known ligand 0.46

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
DAO P14920 1/20 0.46
PDE10A Q9Y233 3/20 0.41
HPGD P15428 5/20 0.37
KDM4E B2RXH2 4/20 0.37
KMT2A Q03164 3/20 0.37
HTT P42858 2/20 0.37
MEN1 O00255 2/20 0.37
TSHR P16473 2/20 0.37
PSMD14 O00487 1/20 0.37
CYP1A2 P05177 1/20 0.37
CYP2A6 P11509 1/20 0.37
ALDH1A1 P00352 3/20 0.36
GAA P10253 1/20 0.36
MAPT P10636 1/20 0.36
ACHE P22303 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35
FAAH O00519 1/20 0.35
MAPK1 P28482 1/20 0.35

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
SCHEMBL6086864 0.90 HPGD (0.44) HPGDKDM4EKMT2AHTTMEN1
SCHEMBL6087450 0.87 MAPT (0.42) HPGDKDM4EKMT2AHTTMEN1
SCHEMBL6087044 0.86 SMN1; SMN2 (0.37) DAOHPGDKDM4EKMT2AHTT
SCHEMBL6088271 0.85 NPBWR1 (0.35) PDE10AHPGDKDM4EKMT2AHTT
SCHEMBL6087068 0.85 DAO (0.46) DAOPDE10AHPGDKDM4EKMT2A
SCHEMBL6086483 0.85 MTNR1A (0.50) DAOKMT2AMEN1TSHRALDH1A1
SCHEMBL6086356 0.84 PDE10A (0.42) PDE10AKDM4ECYP1A2ALDH1A1
SCHEMBL6087695 0.82 GRIN1 (0.44) KMT2A
SCHEMBL6085671 0.82 GRIN1 (0.44) HPGDALDH1A1MAPK1
SCHEMBL10204457 0.82 TPH1 (0.35) HPGDKDM4EKMT2AHTTMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6987114-B1 Antiviral pyrimidinedione derivatives and process for the preparation thereof SAMJIN PHARMACEUTICAL CO., LTD (KR) 2006-01-17 US disclosed
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