SCHEMBL7377448

SCHEMBL7377448

CCC(=O)c1ccc(=O)[nH]c1C=CN(C)C

nearest known ligand 0.35

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ HSP90AB1 P08238 1/20 0.35
▸ ALDH1A1 P00352 2/20 0.34
▸ CA9 Q16790 1/20 0.31
▸ NPC1 O15118 1/20 0.31
▸ MAPT P10636 1/20 0.31
▸ RAB9A P51151 1/20 0.31
▸ KMT2A Q03164 1/20 0.31
▸ POLB P06746 1/20 0.31

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
SCHEMBL7377447 1.00 HSP90AB1 (0.35) HSP90AB1ALDH1A1CA9NPC1MAPT
SCHEMBL10811980 0.89 HTT (0.35) ALDH1A1NPC1MAPTRAB9AKMT2A
SCHEMBL10813620 0.89 HTT (0.35) ALDH1A1NPC1MAPTRAB9AKMT2A
SCHEMBL10812004 0.87 HTT (0.42) MAPT
SCHEMBL7381643 0.83 MAPT (0.36) ALDH1A1NPC1MAPTRAB9AKMT2A
SCHEMBL7381640 0.83 MAPT (0.36) ALDH1A1NPC1MAPTRAB9AKMT2A
SCHEMBL10379107 0.79 KMT2A (0.39) ALDH1A1NPC1MAPTRAB9AKMT2A
SCHEMBL10378562 0.79 KMT2A (0.39) ALDH1A1NPC1MAPTRAB9AKMT2A
SCHEMBL10377662 0.77 RECQL (0.43) ALDH1A1NPC1MAPTRAB9AKMT2A
SCHEMBL10377561 0.76 ALDH1A1 (0.40) ALDH1A1NPC1MAPTRAB9AKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4559347-A 3-Substituted-5-alkyl-1,6-naphthyridin-2(1H)-ones, cardiotonic use and preparation thereof STERLING DRUG INC. (US) 1985-12-17 — — US claimed
US-4415580-A Certain 2-(1H)-pyridinones cardiotonic compositions containing same and method of using same STERLING DRUG INC. (US) 1983-11-15 — — US claimed
EP-0134535-B1 1,6-NAPHTHYRIDIN DERIVATIVES USEFUL AS CARDIOTONICS AND PREPARATION THEREOF STERLING DRUG INC. (US) 1988-10-26 — — EP disclosed
EP-0101952-B1 5-ALKYL-1,6-NAPHTHYRIDIN-2(1H)-ONES, INTERMEDIATES, THEIR PREPARATION AND THEIR CARDIOTONIC USE STERLING DRUG INC. (US) 1987-09-23 — — EP disclosed
US-4604399-A 5-methyl(or ethyl)-1,6-naphthyridin-2(1H)-one 6-oxides, their preparation and the cardiotonic use thereof STERLING DRUG INC. (US) 1986-08-05 — — US disclosed
US-4559347-A 3-Substituted-5-alkyl-1,6-naphthyridin-2(1H)-ones, cardiotonic use and preparation thereof STERLING DRUG INC. (US) 1985-12-17 — — US disclosed
US-4532247-A Increases cardiac contractility STERLING DRUG INC. (US) 1985-07-30 — — US disclosed
US-4517190-A 5-Alkyl-1,6-naphthyridin-2(1H)-ones and cardiotonic use thereof STERLING DRUG INC. (US) 1985-05-14 — — US disclosed
EP-0134535-A1 1,6-Naphthyridin derivatives useful as cardiotonics and preparation thereof STERLING DRUG INC. (US) 1985-03-20 — — EP disclosed
EP-0101952-A1 5-Alkyl-1,6-naphthyridin-2(1H)-ones, intermediates, their preparation and their cardiotonic use STERLING DRUG INC. (US) 1984-03-07 — — EP disclosed
US-4415580-A Certain 2-(1H)-pyridinones cardiotonic compositions containing same and method of using same STERLING DRUG INC. (US) 1983-11-15 — — US disclosed
Send feedback