SCHEMBL6529317

SCHEMBL6529317

Cc1c(N2CCC(O)C(CO)C2)cc(Nc2cccc3[nH]c(=O)[nH]c(=O)c23)c2c(=O)[nH]c(=O)n(C3CC3)c12

nearest known ligand 0.31

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
TPH1 P17752 3/20 0.31
TPH2 Q8IWU9 3/20 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
SCHEMBL6527250 0.85 OPRM1 (0.32) TPH1TPH2
SCHEMBL6528371 0.85 OPRM1 (0.32) TPH1TPH2
SCHEMBL6528178 0.80 EEF2K (0.33)
SCHEMBL6531409 0.76 JAK2 (0.32) TPH1TPH2
SCHEMBL6529057 0.75
SCHEMBL6370154 0.75 TK1 (0.36)
SCHEMBL6532087 0.73
SCHEMBL6671058 0.71 KCNH2 (0.33)
SCHEMBL6372782 0.69 KCNH2 (0.41)
SCHEMBL6528433 0.69 PRKDC (0.31)

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2005026145-A2 QUINOLONE ANTIBACTERIAL AGENTS WARNER-LAMBERT COMPANY LLC (US) 2005-03-24 WO claimed
WO-2005026145-A2 QUINOLONE ANTIBACTERIAL AGENTS WARNER-LAMBERT COMPANY LLC (US) 2005-03-24 WO disclosed