SCHEMBL11243357

SCHEMBL11243357

CCc1cnccc1-c1ccc(=O)n(C)n1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 9/20 0.38
CCNC P24863 1/20 0.38
CDK8 P49336 1/20 0.38
BRD4 O60885 1/20 0.35
PKM P14618 1/20 0.33
PDE10A Q9Y233 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
MEN1 O00255 2/20 0.33
KMT2A Q03164 2/20 0.33
MAPT P10636 1/20 0.33
CYP1A2 P05177 1/20 0.32
CYP3A4 P08684 1/20 0.32
GAA P10253 1/20 0.32
TSHR P16473 1/20 0.32
CYP2C19 P33261 1/20 0.32
KDM4E B2RXH2 1/20 0.32
ALDH1A1 P00352 1/20 0.32
RAB9A P51151 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
MAOA P21397 1/20 0.32

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
SCHEMBL11242510 0.77 CCNC (0.38) CCNCCDK8NPSR1CYP1A2CYP3A4
SCHEMBL32666872 0.77 HRH3 (0.36) HRH3BRD4CYP1A2CYP3A4GAA
SCHEMBL11231804 0.72 HRH3 (0.51) HRH3MAPTKCNH2
SCHEMBL15528383 0.72 NOTUM (0.44) CCNCCDK8NPSR1MEN1KMT2A
SCHEMBL4061767 0.71 CYP2A6 (0.50) HRH3CYP1A2CYP3A4CYP2C19ALDH1A1
SCHEMBL11240696 0.71 LMNA (0.42) CCNCCDK8PDE10AMEN1KMT2A
SCHEMBL611694 0.71 HRH3 (0.42) HRH3BRD4PKMKDM4EALDH1A1
SCHEMBL11233030 0.69 CCNC (0.40) CCNCCDK8CYP1A2CYP3A4CYP2C19
SCHEMBL10843010 0.69 CCNC (0.40) CCNCCDK8MEN1KMT2AMAPT
SCHEMBL11257121 0.69 CCNC (0.38) CCNCCDK8MEN1KMT2AMAPT

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-4346221-A Preparation of 4-amino-6-(pyridinyl)-3(2H)-pyridazinones from 6-(pyridinyl)-3(2H)-pyridazinones STERLING DRUG INC. (US) 1982-08-24 US disclosed
US-4338446-A Di-(lower-alkyl)hydroxy-[2-oxo-2-(pyridinyl)ethyl]-propanedioates STERLING DRUG INC. (US) 1982-07-06 US disclosed
US-4337253-A 4,5-Dihydro-2-methyl-6-(4-pyridinyl)-3(2H)-pyridazinone and its use as a cardiotonic STERLING DRUG INC. (US) 1982-06-29 US disclosed
US-4305943-A 4-Amino-6-(pyridinyl)-3(2H)-pyridazinones and their use as cardiotonics STERLING DRUG INC. (US) 1981-12-15 US disclosed
US-4304776-A 4-Substituted-6-(pyridinyl)-3(2h)-pyridazinones and their use as intermediates and cardiotonics STERLING DRUG INC. (US) 1981-12-08 US disclosed
US-4304777-A 6-(Pyridinyl)-3(2H)-pyridazinones and their use as cardiotonics STERLING DRUG INC. (US) 1981-12-08 US disclosed