SCHEMBL30823792

SCHEMBL30823792

O=C(c1ccnc(Br)c1)N1CCC(N2CCc3ccccc3C2)CC1

nearest known ligand 0.57

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ ADRA1A P35348 11/20 0.57
▸ HRH3 Q9Y5N1 1/20 0.49
▸ L3MBTL3 Q96JM7 4/20 0.47
▸ L3MBTL1 Q9Y468 3/20 0.47
▸ L3MBTL4 Q8NA19 1/20 0.47
▸ MBTD1 Q05BQ5 1/20 0.46
▸ HPGD P15428 1/20 0.46
▸ HTT P42858 1/20 0.46
▸ SMN1; SMN2 Q16637 1/20 0.46

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
SCHEMBL22418721 1.00 ADRA1A (0.57) ADRA1AHRH3L3MBTL3L3MBTL1L3MBTL4
SCHEMBL30823777 0.84 L3MBTL3 (0.68) ADRA1AL3MBTL3L3MBTL1L3MBTL4MBTD1
SCHEMBL22418708 0.84 L3MBTL3 (0.68) ADRA1AL3MBTL3L3MBTL1L3MBTL4MBTD1
SCHEMBL22418675 0.83 ADRA1A (0.52) ADRA1AHRH3L3MBTL3L3MBTL1L3MBTL4
SCHEMBL30823788 0.83 ADRA1A (0.52) ADRA1AHRH3L3MBTL3L3MBTL1L3MBTL4
SCHEMBL22418687 0.81 ADRA1A (0.54) ADRA1A
SCHEMBL30823774 0.81 ADRA1A (0.54) ADRA1A
SCHEMBL22432798 0.81 ADRA1A (0.56) ADRA1AL3MBTL3L3MBTL1
SCHEMBL22432698 0.79 PRMT5 (0.60) ADRA1A
SCHEMBL22418711 0.79 ADRA1A (0.61) ADRA1AL3MBTL3L3MBTL1L3MBTL4MBTD1

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-113330009-B Azacyclic compounds, preparation method and application thereof 四川科伦博泰生物医药股份有限公司 2024-02-09 — — CN disclosed
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