SCHEMBL15049874

SCHEMBL15049874

Cc1cc(Cl)ccc1C1=CC(C)(C)Oc2cc(CN[SH](=O)=O)ccc21

nearest known ligand 0.31

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MAOB P27338 1/20 0.31
CYP11B2 P19099 3/20 0.31
LMNA P02545 1/20 0.31
NOTUM Q6P988 1/20 0.30
RARA P10276 1/20 0.30
RARB P10826 1/20 0.30
RARG P13631 1/20 0.30

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
SCHEMBL14666697 0.77 KDM4E (0.32) NOTUMRARARARBRARG
SCHEMBL3030847 0.76 CYP17A1 (0.42)
SCHEMBL14666749 0.73 MAOB (0.40) MAOBLMNA
SCHEMBL15049784 0.70 MAOB (0.34) MAOBLMNA
SCHEMBL15049903 0.70 PTGES (0.33) MAOB
SCHEMBL12082364 0.69 CHRM1 (0.38) MAOBLMNARARARARBRARG
SCHEMBL15049778 0.67 CNR1 (0.30)
SCHEMBL15049801 0.67 RARA (0.31) RARARARBRARG
SCHEMBL14822879 0.67 RARA (0.40) RARARARBRARG
SCHEMBL15049759 0.67 MEN1 (0.32) MAOBLMNA

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-2179994-B1 FUSED BICYCLIC COMPOUND MITSUBISHI TANABE PHARMA CORP (JP) 2013-06-26 EP claimed