SCHEMBL312952

SCHEMBL312952

CCc1cccc(-n2ccccc2=O)c1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MGLL Q99685 1/20 0.56
▸ ALOX5 P09917 1/20 0.46
▸ GRM2 Q14416 1/20 0.40
▸ MAPK1 P28482 2/20 0.40
▸ SOD1 P00441 1/20 0.40
▸ HPGD P15428 1/20 0.40
▸ MAPT P10636 3/20 0.40
▸ SMN1; SMN2 Q16637 2/20 0.40
▸ NPC1 O15118 1/20 0.40
▸ ALDH1A1 P00352 1/20 0.40
▸ LMNA P02545 1/20 0.40
▸ RAB9A P51151 1/20 0.40
▸ L3MBTL1 Q9Y468 1/20 0.40
▸ CYP3A4 P08684 1/20 0.39
▸ CYP2C9 P11712 1/20 0.39
▸ TP53 P04637 2/20 0.39
▸ NR1H3 Q13133 1/20 0.38
▸ GRM1 Q13255 1/20 0.38
▸ ESRRA P11474 1/20 0.38
▸ ROCK2 O75116 1/20 0.38

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
SCHEMBL14490265 0.80 MGLL (0.48) MGLLMAPK1HPGDMAPTSMN1; SMN2
SCHEMBL10059343 0.79 HSD17B10 (0.60) MGLLALOX5HPGDMAPTSMN1; SMN2
SCHEMBL6536599 0.77 CYP1A2 (0.53) MGLLHPGDMAPTSMN1; SMN2NPC1
SCHEMBL21257468 0.77 CRBN (0.59) MGLLALOX5SOD1HPGDMAPT
SCHEMBL6535778 0.77 HSP90AA1 (0.52) MGLLALOX5HPGDMAPTALDH1A1
SCHEMBL327268 0.76 MGLL (0.55) MGLLALOX5MAPK1HPGDMAPT
SCHEMBL13932944 0.75 POLB (0.50) MGLLMAPK1HPGDMAPTLMNA
SCHEMBL2222230 0.74 MGLL (0.50) MGLLALDH1A1
SCHEMBL18050078 0.74 MGLL (0.54) MGLLHPGDMAPTSMN1; SMN2ALDH1A1
SCHEMBL21257470 0.73 BIRC5 (0.47) MGLLALOX5TP53ROCK2

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-8093210-B2 Treatment of sepsis with 5-ethyl-1-phenyl-2(1H)-pyridone SOLANAN, INC. (US) 2012-01-10 — — US disclosed
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