SCHEMBL9475528

SCHEMBL9475528

CCCCCC(=O)c1cc(C#N)c(=O)[nH]c1C

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.46
KDM4E B2RXH2 7/20 0.46
LMNA P02545 4/20 0.46
HPGD P15428 3/20 0.46
POLB P06746 3/20 0.46
KMT2A Q03164 4/20 0.44
MEN1 O00255 3/20 0.44
MAPT P10636 3/20 0.44
RXFP1 Q9HBX9 2/20 0.44
GALR3 O60755 1/20 0.42
GAA P10253 1/20 0.42
HTT P42858 1/20 0.40
CYP2C19 P33261 2/20 0.40
TSHR P16473 2/20 0.40
PDE5A O76074 1/20 0.40
PTGS1 P23219 1/20 0.40
PDE4A P27815 1/20 0.40
BLM P54132 1/20 0.40
PDE4B Q07343 1/20 0.40
PDE4C Q08493 1/20 0.40

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
SCHEMBL9475164 1.00 ALDH1A1 (0.46) ALDH1A1KDM4ELMNAHPGDPOLB
SCHEMBL9477002 1.00 ALDH1A1 (0.46) ALDH1A1KDM4ELMNAHPGDPOLB
SCHEMBL9476379 1.00 ALDH1A1 (0.46) ALDH1A1KDM4ELMNAHPGDPOLB
SCHEMBL9475251 0.96 KDM4E (0.46) ALDH1A1KDM4ELMNAHPGDPOLB
SCHEMBL9476022 0.90 ALDH1A1 (0.47) ALDH1A1KDM4ELMNAHPGDPOLB
SCHEMBL10805720 0.85 PDE3B (0.45) ALDH1A1KDM4ELMNAHPGDPOLB
SCHEMBL9478348 0.84 ALDH1A1 (0.49) ALDH1A1KDM4ELMNAHPGDPOLB
SCHEMBL11021287 0.84 ALDH1A1 (0.44) ALDH1A1KDM4ELMNAHPGDPOLB
SCHEMBL11020875 0.84 ALDH1A1 (0.44) ALDH1A1KDM4ELMNAHPGDPOLB
SCHEMBL11022404 0.82 ALDH1A1 (0.45) ALDH1A1KDM4ELMNAHPGDPOLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0124089-B1 NOVEL 5-ACYL-2-(1H)-PYRIDINONES MERRELL DOW PHARMACEUTICALS INC. (US) 1987-03-04 EP claimed
US-5212314-A Alkoxyimino ether derivatives of 5-acyl-2(1H)-pyridinones MERRELL DOW PHARMACEUTICALS INC. (US) 1993-05-18 US disclosed
US-5212315-A Alkoxyimino ether derivatives of 5-acyl-2(1H)-pyridinones MERRELL DOW PHARMACEUTICALS INC. (US) 1993-05-18 US disclosed
EP-0140375-B1 ALKOXYIMINO ETHER DERIVATIVES OF 5-ACYL-2(1H)-PYRIDINONES MERRELL DOW PHARMACEUTICALS INC. (US) 1992-09-23 EP disclosed
US-5043449-A Certain alkoxyimino ether derivatives of 5-acyl-2(1H)-pyridinones MERRELL DOW PHARMACEUTICALS INC. (US) 1991-08-27 US disclosed
US-4920229-A Novel alkoxyimino ether derivatives of 5-acyl-2(1H)-pyridinones MERRELL DOW PHARMACEUTICALS INC. (US) 1990-04-24 US disclosed
US-4849522-A Novel alkoxyimino ether derivatives of 5-acyl-2(1H)-pyridinones MERRELL DOW PHARMACEUTICALS (US) 1989-07-18 US disclosed
US-4732982-A Novel alkoxyimino ether derivatives of 5-acyl-2(1H)-pyridinones MERRELL DOW PHARMACEUTICALS INC. (US) 1988-03-22 US disclosed
EP-0124089-B1 NOVEL 5-ACYL-2-(1H)-PYRIDINONES MERRELL DOW PHARMACEUTICALS INC. (US) 1987-03-04 EP disclosed
US-4568751-A 5-Acyl-2-(1H)-pyridinones MERRELL DOW PHARMACEUTICALS INC. (US) 1986-02-04 US disclosed
EP-0140375-A2 Alkoxyimino ether derivatives of 5-acyl-2(1H)-pyridinones MERRELL DOW PHARMACEUTICALS INC. (US) 1985-05-08 EP disclosed
EP-0124089-A1 Novel 5-acyl-2-(1H)-pyridinones MERRELL DOW PHARMACEUTICALS INC. (US) 1984-11-07 EP disclosed