SCHEMBL30530074

SCHEMBL30530074

Cc1cc(F)ccc1Oc1ccccc1C(=O)Nc1cccc(C#N)c1

nearest known ligand 0.69

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ SCN8A Q9UQD0 3/20 0.64
▸ SCN10A Q9Y5Y9 3/20 0.64
▸ RXFP1 Q9HBX9 1/20 0.58
▸ HTT P42858 1/20 0.56
▸ LRRK2 Q5S007 1/20 0.52

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
SCHEMBL25374968 1.00 SCN8A (0.64) SCN8ASCN10ARXFP1HTTLRRK2
SCHEMBL30530093 0.90 SCN8A (0.64) SCN8ASCN10A
SCHEMBL25373660 0.90 SCN8A (0.64) SCN8ASCN10A
SCHEMBL25373117 0.89 SCN8A (0.65) SCN8ASCN10A
SCHEMBL25375203 0.88 LRRK2 (0.68) SCN8ASCN10ALRRK2
SCHEMBL31606710 0.88 SCN8A (0.68) SCN8ASCN10ARXFP1LRRK2
SCHEMBL30530087 0.88 LRRK2 (0.68) SCN8ASCN10ALRRK2
SCHEMBL25375071 0.88 SCN8A (0.63) SCN8ASCN10A
SCHEMBL25375406 0.88 SCN8A (0.68) SCN8ASCN10ARXFP1LRRK2
SCHEMBL30530067 0.88 SCN8A (0.63) SCN8ASCN10A

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
CN-116655497-B Amidine derivative compound and preparation method and application thereof 中国科学院上海药物研究所 2025-06-03 — — CN disclosed
CN-116655497-A Amidine derivative compound and preparation method and application thereof 中国科学院上海药物研究所 2023-08-29 — — CN disclosed
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