SCHEMBL29329343

SCHEMBL29329343

Fc1ccc(Oc2ncnc3c2CCNC3)c(Br)c1

nearest known ligand 0.41

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
TRPC5 Q9UL62 7/20 0.41
TRPC4 Q9UBN4 2/20 0.39
KDR P35968 7/20 0.38
TRPA1 O75762 6/20 0.37
KCNH2 Q12809 2/20 0.37

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
SCHEMBL21807225 0.84 TRPC5 (0.55) TRPC5TRPC4KDRTRPA1KCNH2
SCHEMBL29090290 0.84 TRPC5 (0.55) TRPC5TRPC4KDRTRPA1KCNH2
SCHEMBL29090296 0.84 KDR (0.41) TRPC5TRPC4KDRTRPA1KCNH2
SCHEMBL30603341 0.84 TRPC5 (0.55) TRPC5TRPC4KDRTRPA1KCNH2
SCHEMBL30603350 0.83 TRPC5 (0.55) TRPC5TRPC4KDR
SCHEMBL29090308 0.83 TRPC5 (0.55) TRPC5TRPC4KDR
SCHEMBL29329748 0.82 KDR (0.41) TRPC5TRPC4KDRTRPA1KCNH2
SCHEMBL29329653 0.82 TRPC5 (0.39) TRPC5TRPC4KDRTRPA1KCNH2
SCHEMBL29090295 0.81 HSPB1 (0.40) TRPC5TRPC4KDRKCNH2
SCHEMBL21807310 0.75 KDR (0.38) TRPC5KDRTRPA1KCNH2

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