SCHEMBL6086491

SCHEMBL6086491

Cc1cc(C)cc(Oc2c(C(C)C)c(=O)[nH]c(=O)n2Cc2cc(Cl)cc(Cl)c2)c1

nearest known ligand 0.42

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
PDE5A O76074 1/20 0.33
PDE9A O76083 1/20 0.33
PDE1A P54750 1/20 0.33
PDE1B Q01064 1/20 0.33
PDE1C Q14123 1/20 0.33
TLR7 Q9NYK1 1/20 0.32
HPGD P15428 4/20 0.32
MEN1 O00255 3/20 0.32
KMT2A Q03164 3/20 0.32
KDM4E B2RXH2 2/20 0.32
TSHR P16473 2/20 0.32
HTT P42858 2/20 0.32
PSMD14 O00487 1/20 0.32
P2RX3 P56373 2/20 0.31
ALDH1A1 P00352 4/20 0.31
MAPT P10636 2/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
MAPK1 P28482 1/20 0.31
GAA P10253 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
SCHEMBL7855069 0.92 TYMP (0.31) PDE5APDE9APDE1APDE1BPDE1C
SCHEMBL6087128 0.92 TPH1 (0.34) TLR7HPGDMEN1KMT2AKDM4E
SCHEMBL6087770 0.89 TYMS (0.37) TLR7HPGDMEN1KMT2ATSHR
SCHEMBL6086817 0.89 HPGD (0.43) TLR7HPGDMEN1KMT2AKDM4E
SCHEMBL6088310 0.87 GRIN1 (0.36) TLR7KMT2AALDH1A1
SCHEMBL6088314 0.87 MTNR1A (0.37) HPGDMEN1KMT2AKDM4EHTT
SCHEMBL501608 0.85 GRIN1 (0.33) TLR7HPGDMEN1KMT2AKDM4E
SCHEMBL10204278 0.85 TLR7 (0.37) TLR7HPGDMEN1KMT2AKDM4E
SCHEMBL6086296 0.84 TSHR (0.34) HPGDMEN1KMT2ATSHRALDH1A1
SCHEMBL6086604 0.83 DRD1 (0.33) HPGDMEN1KMT2AKDM4ETSHR

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