SCHEMBL21675776

SCHEMBL21675776

Cc1cc(P)c(F)cc1F

nearest known ligand 0.33

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ GPR3 P46089 1/20 0.32
▸ ACHE P22303 1/20 0.32
▸ DAO P14920 1/20 0.31

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
SCHEMBL19311682 0.83 GPR3 (0.32) GPR3ACHEDAO
SCHEMBL10147311 0.78 ACHE (0.40) GPR3ACHEDAO
SCHEMBL20220230 0.78 GPR3 (0.32) GPR3ACHEDAO
SCHEMBL25606228 0.77 CYP3A4 (0.35) —
SCHEMBL823783 0.76 ACHE (0.38) GPR3ACHEDAO
SCHEMBL261036 0.75 ACHE (0.42) GPR3ACHEDAO
Hydrochloric Acid SCHEMBL29178225 0.73 ACHE (0.36) GPR3ACHEDAO
Bromide SCHEMBL28031443 0.73 ACHE (0.36) GPR3ACHEDAO
SCHEMBL25606299 0.72 — —
Methyl Alcohol SCHEMBL28273171 0.71 DAO (0.36) GPR3ACHEDAO

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-2930170-B1 PYRIDONE COMPOUND FOR USE IN THE TREATMENT OF DERMATOLOGICAL DISORDERS KYOWA KIRIN CO LTD (JP) 2020-02-05 — — EP disclosed
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