SCHEMBL6085740

SCHEMBL6085740

CCc1c(C(=O)c2cc(C)cc(C)c2)n(Cc2cccc(Cl)n2)c(=O)[nH]c1=O

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 5/20 0.34
MEN1 O00255 4/20 0.34
TPH1 P17752 1/20 0.34
TPH2 Q8IWU9 1/20 0.34
TSHR P16473 3/20 0.33
KDM4E B2RXH2 2/20 0.33
MAPK1 P28482 1/20 0.33
PSMD14 O00487 1/20 0.33
HPGD P15428 1/20 0.33
HTT P42858 1/20 0.33
HDAC8 Q9BY41 2/20 0.33
HDAC6 Q9UBN7 2/20 0.33
CYP3A4 P08684 1/20 0.33
CYP2C9 P11712 1/20 0.33
PKM P14618 1/20 0.33
CYP2C19 P33261 1/20 0.33
TLR7 Q9NYK1 1/20 0.33
GAA P10253 1/20 0.33
LMNA P02545 1/20 0.33
POLB P06746 1/20 0.33

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
SCHEMBL6097406 0.88 ACKR3 (0.38) KMT2AMEN1TPH1TPH2TSHR
SCHEMBL6087230 0.86 KMT2A (0.33) KMT2AMEN1TPH1TPH2TSHR
SCHEMBL7847583 0.85 TLR7 (0.32) KMT2AMEN1TPH1TPH2KDM4E
SCHEMBL6086631 0.84 GRIN1 (0.45) KMT2ATPH1TPH2TLR7
SCHEMBL6087616 0.83 PDE10A (0.40) KMT2AMEN1KDM4ECYP3A4TDP1
SCHEMBL6087483 0.83 MEN1 (0.43) KMT2AMEN1TSHRKDM4EMAPK1
SCHEMBL6086113 0.80 TSHR (0.35) KMT2AMEN1TPH1TPH2TSHR
SCHEMBL6087138 0.80 DRD1 (0.36) KMT2AMEN1TPH1TPH2TSHR
SCHEMBL6089500 0.79 TPH1 (0.38) KMT2AMEN1TPH1TPH2TSHR
SCHEMBL6086074 0.79 MEN1 (0.35) KMT2AMEN1TPH1TPH2TSHR

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 1 patent. 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