SCHEMBL30771669

SCHEMBL30771669

c1ncc(-c2ccc3nc(N4CCCCC4)ccc3c2)cn1

nearest known ligand 0.43

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ HTR3A P46098 1/20 0.43
▸ HRH4 Q9H3N8 1/20 0.43
▸ MAP4K4 O95819 1/20 0.43
▸ HRH3 Q9Y5N1 2/20 0.42
▸ RXFP1 Q9HBX9 2/20 0.42
▸ MAOB P27338 7/20 0.41
▸ CNR2 P34972 1/20 0.40
▸ TERT O14746 1/20 0.40
▸ PDE10A Q9Y233 1/20 0.39

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
SCHEMBL30771681 0.85 CYP11B2 (0.50) MAOB
SCHEMBL30340907 0.84 CSNK1D (0.50) HTR3AHRH4HRH3RXFP1MAOB
SCHEMBL30771693 0.81 PIM1 (0.51) HTR3AHRH4HRH3RXFP1MAOB
SCHEMBL30340909 0.81 MAOB (0.58) HTR3AHRH4HRH3RXFP1MAOB
SCHEMBL30771686 0.80 FTO (0.49) HTR3AHRH4HRH3MAOBCNR2
SCHEMBL23602813 0.80 HRH3 (0.45) MAP4K4HRH3RXFP1
SCHEMBL30771690 0.80 CNR2 (0.50) HTR3AHRH4HRH3CNR2PDE10A
SCHEMBL30771676 0.80 MAOB (0.44) HTR3AHRH4MAP4K4HRH3RXFP1
SCHEMBL30340903 0.78 MAOB (0.60) HTR3AHRH4HRH3MAOB
SCHEMBL30771674 0.78 HRH3 (0.56) HTR3AHRH4HRH3RXFP1MAOB

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-4081304-B1 ANTIBACTERIAL QUINOLINES TECNIMEDE SOCIEDADE TECNICO MEDICINAL SA (PT) 2024-03-06 — — EP claimed
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