SCHEMBL8933555

SCHEMBL8933555

CC(O)c1c[nH]c(=O)[nH]c1=O

nearest known ligand 0.48

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
GAA P10253 2/20 0.48
ATAD2 Q6PL18 1/20 0.48
HCAR2 Q8TDS4 2/20 0.45
DPYD Q12882 4/20 0.44
MAPT P10636 3/20 0.43
ALDH1A1 P00352 2/20 0.43
LMNA P02545 2/20 0.43
CYP19A1 P11511 1/20 0.43
TSHR P16473 1/20 0.43
THPO P40225 1/20 0.43
MTOR P42345 1/20 0.43
HTT P42858 1/20 0.43
HBB P68871 1/20 0.43
PMP22 Q01453 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
KDM4C Q9H3R0 1/20 0.35
POLB P06746 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
SCHEMBL1918404 0.83 ATAD2 (0.52) GAAATAD2HCAR2DPYDMAPT
SCHEMBL887700 0.79 ATAD2 (0.48) GAAATAD2DPYDMAPTALDH1A1
SCHEMBL19429499 0.79 GAA (0.44) GAAATAD2DPYDMAPTALDH1A1
SCHEMBL28699194 0.79 GAA (0.44) GAAATAD2DPYDMAPTALDH1A1
SCHEMBL30166019 0.76 LMNA (0.45) GAAATAD2DPYDMAPTALDH1A1
SCHEMBL22017500 0.76 ATAD2 (0.45) GAAATAD2DPYDMAPTALDH1A1
SCHEMBL103606 0.76 GAA (0.45) GAAATAD2DPYDMAPTALDH1A1
SCHEMBL17060272 0.76 ATAD2 (0.45) GAAATAD2DPYDMAPTALDH1A1
SCHEMBL7255538 0.76 ATAD2 (0.45) GAAATAD2DPYDMAPTALDH1A1
SCHEMBL2168959 0.76 DPYD (0.46) GAAATAD2DPYDMAPTALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115895561-B Water-based polyurethane adhesive with low viscosity and high thixotropic index and preparation method thereof 南通高盟新材料有限公司 2024-06-25 CN disclosed
CN-115895561-A Water-based polyurethane adhesive with low viscosity and high thixotropic index and preparation method thereof 南通高盟新材料有限公司 2023-04-04 CN disclosed
WO-2021085389-A1 2,6-DIOXO-3,6-DIHYDROPYRIMIDINE COMPOUND, AGRICULTURAL AND HORTICULTURAL BACTERICIDE, NEMATICIDE, AND MEDICAL AND VETERINARY ANTIFUNGAL AGENT 日本曹達株式会社 2021-05-06 WO disclosed
WO-2017053729-A1 NUCLEASE-MEDIATED GENOME EDITING OF PRIMARY CELLS AND ENRICHMENT THEREOF THE BOARD OF TRUSTEES OF THE LELAND STANFORD JUNIOR UNIVERSITY (US) 2017-03-30 WO disclosed
WO-1996032403-A2 NOVEL CYTOSINE AND CYTIDINE DERIVATIVES SCHERING AKTIENGESELLSCHAFT (DE) 1996-10-17 WO disclosed