SCHEMBL25668259

SCHEMBL25668259

CC(N)c1ncnn1-c1ccc(=O)[nH]n1

nearest known ligand 0.36

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
OGA O60502 2/20 0.36
HRH3 Q9Y5N1 1/20 0.33
PDE3A Q14432 2/20 0.33
PDE5A O76074 1/20 0.33
KMT2A Q03164 2/20 0.32
PDE4B Q07343 1/20 0.30
MEN1 O00255 1/20 0.30
LMNA P02545 1/20 0.30

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
SCHEMBL26474883 1.00 OGA (0.36) OGAHRH3PDE3APDE5AKMT2A
Hydrochloric Acid SCHEMBL25232914 0.99 OGA (0.36) OGAHRH3PDE3APDE5AKMT2A
SCHEMBL25668201 0.74 ALDH1A1 (0.36) HRH3KMT2AMEN1LMNA
SCHEMBL25668156 0.74 ALDH1A1 (0.36) HRH3KMT2AMEN1LMNA
SCHEMBL25276182 0.74 HRH3 (0.35) OGAHRH3KMT2ALMNA
SCHEMBL25276183 0.74 HRH3 (0.35) OGAHRH3KMT2ALMNA
Hydrochloric Acid SCHEMBL25234468 0.73 ALDH1A1 (0.35) HRH3KMT2AMEN1LMNA
SCHEMBL26474840 0.71 HRH3 (0.36) HRH3
SCHEMBL25668225 0.71 HRH3 (0.36) HRH3
SCHEMBL30980005 0.71 CYP1A2 (0.39) KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023104714-A1 PESTICIDALLY ACTIVE PYRIDAZINONE COMPOUNDS SYNGENTA CROP PROTECTION AG (CH) 2023-06-15 WO disclosed
WO-2023072849-A1 PESTICIDALLY ACTIVE PYRIDAZINONE COMPOUNDS SYNGENTA CROP PROTECTION AG (CH) 2023-05-04 WO disclosed