SCHEMBL9877029

SCHEMBL9877029

CCN(CC)CCCNC(=O)Cn1ncc(-c2ccc(F)cc2)c1-c1ccc(F)cc1

nearest known ligand 0.50

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.50
TP53 P04637 7/20 0.46
ALDH1A1 P00352 2/20 0.46
MAPK1 P28482 1/20 0.44
KDM4E B2RXH2 2/20 0.44
CYP2D6 P10635 1/20 0.44
KMT2A Q03164 3/20 0.42
MEN1 O00255 2/20 0.42
GAA P10253 1/20 0.41

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
SCHEMBL9878705 0.96 POLB (0.51) POLBTP53ALDH1A1MAPK1KDM4E
Ipazilide SCHEMBL635854 0.89 MAPK1 (0.55) POLBTP53ALDH1A1MAPK1KDM4E
Ipazilide SCHEMBL9877353 0.88 MAPK1 (0.54) POLBTP53ALDH1A1MAPK1KDM4E
SCHEMBL9877376 0.87 MAPK1 (0.51) POLBTP53ALDH1A1MAPK1KDM4E
SCHEMBL9878032 0.87 MAPK1 (0.51) POLBTP53ALDH1A1MAPK1KDM4E
SCHEMBL10556849 0.86 MAPK1 (0.50) POLBTP53ALDH1A1MAPK1KDM4E
SCHEMBL9877916 0.86 MAPK1 (0.50) POLBTP53ALDH1A1MAPK1KDM4E
SCHEMBL10358746 0.85 TP53 (0.52) POLBTP53ALDH1A1MAPK1KDM4E
Ipazilide SCHEMBL120490 0.85 MAPK1 (0.51) POLBTP53ALDH1A1MAPK1KDM4E
Ipazilide SCHEMBL120491 0.85 MAPK1 (0.51) POLBTP53ALDH1A1MAPK1KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4988725-A Cardiovascular disorders, antiarrhythmia agents STERLING DRUG INC. (US) 1991-01-29 US disclosed
EP-0299407-B1 1H-PYRAZOLE-1-ALKANAMIDES AND PREPARATION USEFUL AS ANTIARRHYTHMIC AGENTS STERLING DRUG INC. (US) 1990-10-24 EP disclosed
EP-0388654-A2 Azole-1-alkanamides as antiarrhythmic agents and preparation thereof STERLING DRUG INC. (US) 1990-09-26 EP disclosed
US-4916150-A 1H-pyrazole-1-alkanamines antiarrhythmic compositions and use STERLING DRUG INC. (US) 1990-04-10 US disclosed
US-4870095-A 1H-pyrazole-1-alkanamides, antiarrhythmic compositions and use STERLING DRUG, INC. (US) 1989-09-26 US disclosed
EP-0299407-A1 1H-pyrazole-1-alkanamides and preparation useful as antiarrhythmic agents STERLING DRUG INC. (US) 1989-01-18 EP disclosed