SCHEMBL29496124

SCHEMBL29496124

FC1(F)CCN(c2ccc3cccc(Br)c3n2)CC1

nearest known ligand 0.43

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ GAA P10253 1/20 0.43
▸ HTR3A P46098 1/20 0.43
▸ BACE1 P56817 1/20 0.42
▸ CNR2 P34972 1/20 0.41
▸ PDE10A Q9Y233 2/20 0.41
▸ TRPV3 Q8NET8 1/20 0.39
▸ ADRB1 P08588 1/20 0.38
▸ HRH3 Q9Y5N1 2/20 0.35

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
SCHEMBL28722181 1.00 GAA (0.43) GAAHTR3ABACE1CNR2PDE10A
SCHEMBL28722001 0.83 GAA (0.49) GAAHTR3ABACE1ADRB1HRH3
SCHEMBL29495994 0.83 GAA (0.49) GAAHTR3ABACE1ADRB1HRH3
SCHEMBL28722866 0.79 GAA (0.68) GAAHTR3ABACE1
SCHEMBL3299921 0.79 HTR3A (0.58) GAAHTR3ABACE1ADRB1
SCHEMBL29495981 0.79 GAA (0.68) GAAHTR3ABACE1
SCHEMBL17619976 0.76 GRIN2D (0.50) HTR3ACNR2PDE10ATRPV3
SCHEMBL30642980 0.76 GRIN2D (0.50) HTR3ACNR2PDE10ATRPV3
SCHEMBL29496052 0.74 GAA (0.62) GAAHTR3ABACE1CNR2PDE10A
SCHEMBL28722011 0.74 GAA (0.62) GAAHTR3ABACE1CNR2PDE10A

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
CN-114269730-A 5-heteroaryl-pyridin-2-amine compounds as neuropeptide FF receptor antagonists 多曼治疗学公司 2022-04-01 — — CN disclosed
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