SCHEMBL7952913

SCHEMBL7952913

[CH2]CCCNC(=O)c1ccccc1OC

nearest known ligand 0.60

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
HPGD P15428 3/20 0.60
HCRTR1 O43613 2/20 0.60
TP53 P04637 1/20 0.60
GLA P06280 1/20 0.60
NAMPT P43490 1/20 0.60
CTSD P07339 1/20 0.59
L3MBTL1 Q9Y468 2/20 0.57
ALDH1A1 P00352 2/20 0.57
MAPT P10636 1/20 0.57
HDAC3 O15379 1/20 0.56
HDAC1 Q13547 1/20 0.56
POLB P06746 1/20 0.55
KMT2A Q03164 2/20 0.54
MEN1 O00255 1/20 0.54

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
SCHEMBL7956656 0.95 HCRTR1 (0.62) HPGDHCRTR1TP53GLANAMPT
SCHEMBL7954455 0.94 NAMPT (0.64) HPGDHCRTR1TP53GLANAMPT
SCHEMBL7956519 0.91 HPGD (0.63) HPGDHCRTR1TP53GLANAMPT
SCHEMBL11761482 0.89 NAMPT (0.71) HPGDHCRTR1TP53GLANAMPT
SCHEMBL5656202 0.86 HPGD (0.61) HPGDHCRTR1TP53GLANAMPT
SCHEMBL6360354 0.86 TSHR (0.73) HPGDHCRTR1TP53GLANAMPT
SCHEMBL27535510 0.85 HCRTR1 (0.68) HPGDHCRTR1TP53GLANAMPT
SCHEMBL7959709 0.84 HPGD (0.67) HPGDTP53GLACTSDALDH1A1
SCHEMBL11234292 0.84 NAAA (0.67) HPGDHCRTR1TP53GLANAMPT
SCHEMBL2677353 0.84 KMT2A (0.71) HPGDHCRTR1TP53GLANAMPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6245779-B1 ANALGESICS; ANTIINFLAMMATORY AGENTS OTSUKA PHARMACEUTICAL FACTORY, INC. (JP) 2001-06-12 US disclosed
CN-1262685-A Naphthyridine derivatives OTSUKA PHARMA CO LTD (JP) 2000-08-09 CN disclosed
EP-0997463-A1 NAPHTHYRIDINE DERIVATIVES OTSUKA PHARMACEUTICAL FACTORY, INC. (JP) 2000-05-03 EP disclosed