SCHEMBL6087044

SCHEMBL6087044

CCc1c(Oc2cc(C)cc(C)c2)n(Cc2cc(C)cc(C)c2)c(=O)[nH]c1=O

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.37
TPH1 P17752 1/20 0.36
TPH2 Q8IWU9 1/20 0.36
HPGD P15428 5/20 0.35
ALDH1A1 P00352 5/20 0.35
KDM4E B2RXH2 4/20 0.35
HSD17B10 Q99714 1/20 0.35
MEN1 O00255 4/20 0.33
KMT2A Q03164 4/20 0.33
MAPT P10636 4/20 0.33
HTT P42858 2/20 0.33
PSMD14 O00487 1/20 0.33
TSHR P16473 1/20 0.33
PDE3B Q13370 1/20 0.33
PDE3A Q14432 1/20 0.33
DRD1 P21728 2/20 0.32
THRB P10828 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
DAO P14920 1/20 0.32
KDR P35968 1/20 0.32

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
SCHEMBL6086604 0.92 DRD1 (0.33) SMN1; SMN2TPH1TPH2HPGDALDH1A1
SCHEMBL6086132 0.92 TYMS (0.38) SMN1; SMN2TPH1TPH2HPGDALDH1A1
SCHEMBL6086259 0.92 GRIN1 (0.37) SMN1; SMN2TPH1TPH2HPGDALDH1A1
SCHEMBL6085479 0.92 MTNR1A (0.37) SMN1; SMN2HPGDALDH1A1KDM4EHSD17B10
SCHEMBL6086864 0.91 HPGD (0.44) HPGDALDH1A1KDM4EHSD17B10MEN1
SCHEMBL10204457 0.90 TPH1 (0.35) SMN1; SMN2TPH1TPH2HPGDALDH1A1
SCHEMBL6087627 0.89 TSHR (0.34) SMN1; SMN2TPH1TPH2HPGDALDH1A1
SCHEMBL6087014 0.86 DAO (0.46) HPGDALDH1A1KDM4EMEN1KMT2A
SCHEMBL6086483 0.86 MTNR1A (0.50) ALDH1A1HSD17B10MEN1KMT2ATSHR
SCHEMBL6085671 0.85 GRIN1 (0.44) HPGDALDH1A1

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