SCHEMBL10377417

SCHEMBL10377417

COc1ccc(C(=O)c2ccc(=O)[nH]c2C)cc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NPC1 O15118 2/20 0.54
▸ MAPT P10636 3/20 0.50
▸ RAB9A P51151 3/20 0.50
▸ KMT2A Q03164 3/20 0.49
▸ NPSR1 Q6W5P4 4/20 0.47
▸ HTT P42858 3/20 0.47
▸ MAPK1 P28482 3/20 0.47
▸ LMNA P02545 3/20 0.47
▸ HPGD P15428 2/20 0.47
▸ MEN1 O00255 2/20 0.47
▸ RXFP1 Q9HBX9 1/20 0.47
▸ ALDH1A1 P00352 3/20 0.47
▸ SMN1; SMN2 Q16637 2/20 0.47
▸ TP53 P04637 1/20 0.47
▸ CES2 O00748 1/20 0.46
▸ CES1 P23141 1/20 0.46
▸ PLK1 P53350 1/20 0.45
▸ CA1 P00915 2/20 0.44
▸ CA2 P00918 2/20 0.44
▸ CYP1A2 P05177 2/20 0.44

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
SCHEMBL10377444 0.84 KDM4E (0.56) NPC1MAPTRAB9AKMT2ANPSR1
SCHEMBL10377556 0.83 ALDH1A1 (0.52) NPC1MAPTRAB9ALMNAHPGD
SCHEMBL10378565 0.82 MAPT (0.47) NPC1MAPTRAB9AKMT2AHTT
SCHEMBL10378678 0.81 GRM5 (0.43) NPC1MAPTRAB9AKMT2ALMNA
SCHEMBL10377589 0.81 MAPT (0.46) NPC1MAPTRAB9AKMT2ANPSR1
SCHEMBL10378571 0.81 NR4A1 (0.45) NPC1MAPTRAB9AKMT2ANPSR1
SCHEMBL10683064 0.81 NPC1 (0.50) NPC1MAPTRAB9AKMT2ANPSR1
SCHEMBL10378560 0.80 MAPT (0.47) MAPTKMT2ANPSR1HTTMAPK1
SCHEMBL10377414 0.78 PLK1 (0.45) MAPTRAB9AKMT2AHTTLMNA
SCHEMBL10377855 0.77 CA1 (0.42) MAPTALDH1A1CA1CA2CYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4560691-A 5-(Phenyl)-1,6-naphthyridin-2(1H)-ones, their cardiotonic use and preparation STERLING DRUG INC. (US) 1985-12-24 — — US claimed
EP-0168037-B1 1-6-NAPHTHYRIDIN-2(1H)-ONES USEFUL AS CARDIOTONICS STERLING DRUG INC. (US) 1990-02-07 — — EP disclosed
EP-0168037-A2 1-6-Naphthyridin-2(1H)-ones useful as cardiotonics STERLING DRUG INC. (US) 1986-01-15 — — EP disclosed
US-4560691-A 5-(Phenyl)-1,6-naphthyridin-2(1H)-ones, their cardiotonic use and preparation STERLING DRUG INC. (US) 1985-12-24 — — US disclosed
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