SCHEMBL4950187

SCHEMBL4950187

Cc1cc([S+](C)[O-])c2ncc(C(N)=O)c(Nc3cccc4c3CCO4)c2c1

nearest known ligand 0.60

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PDE4B Q07343 4/20 0.60
MTNR1B P49286 1/20 0.38
CSF1R P07333 11/20 0.38
THRB P10828 1/20 0.37
CYP3A4 P08684 1/20 0.35
CYP2C9 P11712 1/20 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
SCHEMBL2482470 0.86 PDE4B (0.60) PDE4BMTNR1BCSF1RTHRB
SCHEMBL4299487 0.86 PDE4B (0.59) PDE4BMTNR1BCSF1RCYP3A4CYP2C9
SCHEMBL4949101 0.84 PDE4B (0.68) PDE4BMTNR1BCSF1RTHRB
Formic Acid SCHEMBL2479146 0.84 PDE4B (0.57) PDE4BMTNR1BCSF1RTHRB
SCHEMBL4949711 0.83 PDE4B (0.64) PDE4BMTNR1BCSF1R
SCHEMBL31020770 0.81 PDE4B (0.61) PDE4BMTNR1BCSF1RTHRB
SCHEMBL4299675 0.80 PDE4B (0.60) PDE4BMTNR1BCSF1RCYP3A4CYP2C9
SCHEMBL4949741 0.80 PDE4B (0.60) PDE4BCSF1R
SCHEMBL2479197 0.79 PDE4B (0.66) PDE4BCSF1R
SCHEMBL2505851 0.79 PDE4B (0.59) PDE4BMTNR1BCSF1RTHRB

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-1633748-B1 QUINOLINE DERIVATIVES AS PHOSPHODIESTERASE INHIBITORS GLAXO GROUP LTD (GB) 2008-03-05 EP claimed