SCHEMBL30530093

SCHEMBL30530093

Cc1cc(F)ccc1Oc1ccc(Cl)cc1C(=O)Nc1cccc(C#N)c1

nearest known ligand 0.69

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ SCN8A Q9UQD0 6/20 0.64
▸ SCN10A Q9Y5Y9 6/20 0.64
▸ P2RX1 P51575 1/20 0.59

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
SCHEMBL25373660 1.00 SCN8A (0.64) SCN8ASCN10AP2RX1
SCHEMBL25373117 0.93 SCN8A (0.65) SCN8ASCN10AP2RX1
SCHEMBL30530074 0.90 SCN8A (0.64) SCN8ASCN10A
SCHEMBL25374968 0.90 SCN8A (0.64) SCN8ASCN10A
SCHEMBL30530080 0.89 SCN8A (0.65) SCN8ASCN10AP2RX1
SCHEMBL25374291 0.89 SCN8A (0.65) SCN8ASCN10AP2RX1
SCHEMBL30530087 0.87 LRRK2 (0.68) SCN8ASCN10A
SCHEMBL25375203 0.87 LRRK2 (0.68) SCN8ASCN10A
SCHEMBL25373555 0.86 SCN8A (0.60) SCN8ASCN10A
SCHEMBL30530115 0.86 SCN8A (0.60) 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 3 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
WO-2023160509-A1 AMIDINE DERIVATIVE COMPOUND, AND PREPARATION METHOD THEREFOR AND USE THEREOF 中国科学院上海药物研究所 2023-08-31 — — WO 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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