SCHEMBL9047648

SCHEMBL9047648

O=C(CCCC1CCCc2[c]cccc21)NC(c1ccccc1)c1ccccc1

nearest known ligand 0.40

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PTGIR P43119 4/20 0.40
LMNA P02545 2/20 0.38
KMT2A Q03164 4/20 0.37
PRCP P42785 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
NPSR1 Q6W5P4 1/20 0.37
ALDH1A1 P00352 5/20 0.37
MEN1 O00255 2/20 0.37
TSHR P16473 1/20 0.36
MAPT P10636 2/20 0.35
HPGD P15428 1/20 0.34
TDP1 Q9NUW8 1/20 0.34
GAA P10253 1/20 0.34

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
SCHEMBL9568000 0.84 ALDH1A1 (0.43) LMNAALDH1A1
SCHEMBL9048344 0.78 PTGIR (0.45) PTGIRLMNAKMT2AL3MBTL1NPSR1
SCHEMBL9048350 0.77 PTGIR (0.69) PTGIR
SCHEMBL9567963 0.77 ALDH1A1 (0.44) PTGIRLMNAKMT2AL3MBTL1ALDH1A1
SCHEMBL9048346 0.75 PTGIR (0.52) PTGIR
SCHEMBL9568012 0.73 TAOK1 (0.35) PTGIRALDH1A1TSHR
SCHEMBL9048207 0.71 PTGIR (0.46) PTGIRLMNAKMT2AL3MBTL1ALDH1A1
SCHEMBL9048216 0.71 PTGIR (0.71) PTGIR
SCHEMBL9568029 0.69 TAOK1 (0.49) KMT2APRCPALDH1A1MEN1TSHR
SCHEMBL9568039 0.69 UGCG (0.52) LMNAKMT2AL3MBTL1ALDH1A1MEN1

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
EP-0542203-B1 Fused benzeneoxyacetic acid derivatives as PGl2 receptor agonists ONO PHARMACEUTICAL CO (JP) 1996-07-03 EP disclosed