SCHEMBL10377589

SCHEMBL10377589

Cc1[nH]c(=O)ccc1C(=O)c1ccc(Br)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 3/20 0.46
▸ MAPK1 P28482 2/20 0.46
▸ NPC1 O15118 2/20 0.46
▸ HTT P42858 1/20 0.46
▸ AKR1C3 P42330 1/20 0.45
▸ KMT2A Q03164 5/20 0.43
▸ HPGD P15428 1/20 0.43
▸ MEN1 O00255 4/20 0.42
▸ LMNA P02545 2/20 0.42
▸ RAB9A P51151 2/20 0.42
▸ NPSR1 Q6W5P4 1/20 0.42
▸ RXFP1 Q9HBX9 1/20 0.42
▸ PDE3B Q13370 1/20 0.40
▸ PDE3A Q14432 1/20 0.40
▸ CES2 O00748 1/20 0.39
▸ CES1 P23141 1/20 0.39
▸ TYMP P19971 1/20 0.38
▸ CA1 P00915 1/20 0.37
▸ CA2 P00918 1/20 0.37
▸ SMN1; SMN2 Q16637 1/20 0.37

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
SCHEMBL10377556 0.86 ALDH1A1 (0.52) MAPTNPC1AKR1C3HPGDLMNA
SCHEMBL10378565 0.85 MAPT (0.47) MAPTMAPK1NPC1HTTKMT2A
SCHEMBL10378571 0.83 NR4A1 (0.45) MAPTMAPK1NPC1KMT2AHPGD
SCHEMBL10378678 0.83 GRM5 (0.43) MAPTNPC1KMT2AMEN1LMNA
SCHEMBL10378560 0.83 MAPT (0.47) MAPTMAPK1HTTAKR1C3KMT2A
SCHEMBL10377417 0.81 NPC1 (0.54) MAPTMAPK1NPC1HTTKMT2A
SCHEMBL10377414 0.81 PLK1 (0.45) MAPTHTTKMT2AHPGDMEN1
SCHEMBL10377855 0.80 CA1 (0.42) MAPTCA1CA2
SCHEMBL10378895 0.78 MAPT (0.50) MAPTMAPK1HTTKMT2AMEN1
SCHEMBL10377444 0.77 KDM4E (0.56) MAPTMAPK1NPC1KMT2AHPGD

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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