SCHEMBL8128024

SCHEMBL8128024

CCCCCCCCCCCCCCCCCCOc1cn(CCC)c(CO)cc1=O

nearest known ligand 0.39

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
COMT P21964 2/20 0.38
TYR P14679 3/20 0.36
GPR84 Q9NQS5 2/20 0.36
MEN1 O00255 1/20 0.36
NR1I2 O75469 1/20 0.36
LMNA P02545 1/20 0.36
CHRM2 P08172 1/20 0.36
CYP3A4 P08684 1/20 0.36
ADRA2A P08913 1/20 0.36
MAPT P10636 1/20 0.36
OPRK1 P41145 1/20 0.36
HTR2B P41595 1/20 0.36
SLC6A3 Q01959 1/20 0.36
KMT2A Q03164 1/20 0.36
HDAC6 Q9UBN7 1/20 0.36
PLA2G2A P14555 1/20 0.35
ALDH1A1 P00352 1/20 0.35
HPGD P15428 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
SCHEMBL8119394 0.88 THRA (0.41)
SCHEMBL8127135 0.86 PTPN11 (0.34) TYRGPR84
SCHEMBL8134142 0.86 SMPD1 (0.39) COMTGPR84MEN1NR1I2LMNA
Bromide SCHEMBL9291148 0.85 PTPN11 (0.34) TYRGPR84
SCHEMBL8130166 0.83 COMT (0.44) COMTTYRMEN1NR1I2LMNA
SCHEMBL8119797 0.83 COMT (0.44) COMTTYRMEN1NR1I2LMNA
SCHEMBL8137123 0.83 COMT (0.44) COMTTYRMEN1NR1I2LMNA
SCHEMBL8137012 0.83 COMT (0.44) COMTTYRMEN1NR1I2LMNA
SCHEMBL8128366 0.82 COMT (0.39) COMTMEN1KMT2AHPGD
SCHEMBL8123164 0.82 COMT (0.39) COMTMEN1MAPTKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0427765-B1 ALKOXY-4(1H)-PYRIDONE DERIVATIVES, PROCESSES FOR PREPARING THEM AND THEIR USE AS DRUGS GOEDECKE AG (DE) 2000-01-05 EP disclosed
US-5322844-A Cardiovascular disorders, antiinflammatory agents, antiallergens GODECKE AKTIENGESELLSCHAFT (DE) 1994-06-21 US disclosed
US-5185352-A Treating or preventing cardiovascular disorders GOEDECKE AKTIENGESELLSCHAFT (DE) 1993-02-09 US disclosed
EP-0427765-A1 ALKOXY-4(1H)-PYRIDONE DERIVATIVES, PROCESSES FOR PREPARING THEM AND THEIR USE AS DRUGS GÖDECKE AKTIENGESELLSCHAFT (DE) 1991-05-22 EP disclosed
WO-1990001477-A1 ALKOXY-4(1H)-PYRIDONE DERIVATIVES, PROCESSES FOR PREPARING THEM AND THEIR USE AS DRUGS Gödecke Aktiengesellschaft (DE) 1990-02-22 WO disclosed
EP-0354495-A1 Alkoxy-4(1H)-pyridone derivatives, process for their preparation and their pharmaceutical use GÖDECKE AKTIENGESELLSCHAFT (DE) 1990-02-14 EP disclosed