SCHEMBL29329902

SCHEMBL29329902

Nc1nc2c(c(Sc3ccc(F)cc3C(F)(F)F)n1)CCN(c1cn[nH]c(=O)c1Cl)C2

nearest known ligand 0.58

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
TRPC5 Q9UL62 18/20 0.58
TRPC4 Q9UBN4 3/20 0.58
KCNH2 Q12809 1/20 0.42
PTPN11 Q06124 1/20 0.40
TIPARP Q7Z3E1 1/20 0.38

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
SCHEMBL29329825 0.88 TRPC5 (0.56) TRPC5TRPC4KCNH2PTPN11
SCHEMBL29090307 0.87 TRPC5 (0.70) TRPC5TRPC4KCNH2
SCHEMBL29329996 0.87 TRPC5 (0.56) TRPC5TRPC4KCNH2
SCHEMBL29329986 0.87 TRPC5 (0.56) TRPC5TRPC4KCNH2
SCHEMBL29329994 0.87 TRPC5 (0.56) TRPC5TRPC4KCNH2
SCHEMBL22002418 0.83 TRPC5 (0.77) TRPC5TRPC4KCNH2
SCHEMBL29090312 0.78 TRPC5 (0.56) TRPC5TRPC4KCNH2TIPARP
SCHEMBL29330209 0.77 TRPC5 (0.59) TRPC5TRPC4TIPARP
SCHEMBL29329354 0.77 TRPC5 (0.59) TRPC5TRPC4TIPARP
SCHEMBL22002481 0.77 TRPC5 (0.64) TRPC5TRPC4KCNH2TIPARP

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4400500-A1 HALOGEN-SUBSTITUTED PYRIDAZINONE COMPOUND AND APPLICATION THEREOF Medshine Discovery Inc. (CN) 2024-07-17 EP disclosed