SCHEMBL7383615

SCHEMBL7383615

CCc1[nH]c(=O)c(C#N)cc1C(=O)c1ccc(N)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PDE3B Q13370 2/20 0.46
▸ PDE3A Q14432 2/20 0.46
▸ MCL1 Q07820 1/20 0.38
▸ KDM4E B2RXH2 11/20 0.36
▸ KMT2A Q03164 5/20 0.36
▸ MEN1 O00255 4/20 0.36
▸ MAPT P10636 3/20 0.36
▸ POLB P06746 2/20 0.36
▸ HSD17B10 Q99714 2/20 0.36
▸ CYP3A4 P08684 1/20 0.35
▸ CYP2D6 P10635 1/20 0.35
▸ CYP2C9 P11712 1/20 0.35
▸ CYP2C19 P33261 1/20 0.35
▸ ALDH1A1 P00352 7/20 0.35
▸ HPGD P15428 4/20 0.35
▸ CRHBP P24387 1/20 0.34
▸ CRHR2 Q13324 1/20 0.34
▸ GALR3 O60755 1/20 0.34
▸ GAA P10253 1/20 0.34
▸ LMNA P02545 2/20 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
SCHEMBL7384614 0.89 PDE3B (0.47) PDE3BPDE3AMCL1KDM4EKMT2A
SCHEMBL7385630 0.85 MAPT (0.45) PDE3BPDE3AKDM4EKMT2AMEN1
SCHEMBL7381645 0.85 PDE3B (0.44) PDE3BPDE3AMCL1KDM4EKMT2A
SCHEMBL7384727 0.85 PDE3B (0.62) PDE3BPDE3AKDM4EKMT2AMAPT
SCHEMBL7382511 0.83 PDE3B (0.43) PDE3BPDE3AKDM4EKMT2AMEN1
SCHEMBL10675823 0.83 CDC7 (0.38) PDE3BPDE3AKMT2AMEN1MAPT
SCHEMBL10678457 0.82 LMNA (0.40) PDE3BPDE3AKMT2AMEN1MAPT
SCHEMBL10681929 0.81 CDC7 (0.42) PDE3BPDE3AKMT2AMEN1MAPT
SCHEMBL10684520 0.81 UCHL1 (0.46) PDE3BPDE3AKDM4EKMT2AMEN1
SCHEMBL7376126 0.81 PDE3B (0.44) PDE3BPDE3AKDM4EKMT2AMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5428045-A 5-acyl-2-(1H)-pyridinoes MERRELL DOW PHARMACEUTICALS INC. (US) 1995-06-27 — — US disclosed
US-5118696-A 5-Acyl-2-(1H)-pyridinones useful for treating cardiac failure MERRELL DOW PHARMACEUTICALS INC. (US) 1992-06-02 — — US disclosed
US-4992452-A Certain 5-acyl-2-(1H)-pyridinones useful in treating cardiac failure MERRELL DOW PHARMACEUTICALS INC. (US) 1991-02-12 — — US disclosed
US-4853395-A Certain 3-carboxylate or 3-carbamyl-5-acyl-2-(1H)-pyridinones having cardiotonic properties MERRELL DOW PHARMACEUTICALS INC. (US) 1989-08-01 — — US disclosed
US-4769380-A Cardiotonic 5-benzoyl-1,2-dihydro-2-oxo-3-pyridinecarboxylates MERRELL DOW PHARMACEUTICALS INC. (US) 1988-09-06 — — US disclosed
US-4731371-A Certain 5-acyl-1,2-dihydro-2-oxo-3-pyridinecarbonitriles which are useful as cardiotonic agents MERRELL DOW PHARMACEUTICALS INC. (US) 1988-03-15 — — US disclosed
EP-0124090-B1 5-ACYL-2-(1H)-PYRIDINONES MERRELL DOW PHARMACEUTICALS INC. (US) 1987-04-01 — — EP disclosed
EP-0124090-A1 5-Acyl-2-(1H)-pyridinones MERRELL DOW PHARMACEUTICALS INC. (US) 1984-11-07 — — EP disclosed
Send feedback