SCHEMBL17977652

SCHEMBL17977652

O=C(O)c1ccc(-c2nn(C(=O)c3c(Cl)cccc3Br)c3c2CCCC3)cc1

nearest known ligand 0.86

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ RORC P51449 18/20 0.86
▸ RARG P13631 1/20 0.53
▸ PPARG P37231 2/20 0.48

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
SCHEMBL17977532 0.93 RORC (1.00) RORCRARGPPARG
SCHEMBL17977577 0.89 RORC (0.88) RORCRARGPPARG
SCHEMBL17977607 0.89 RORC (0.70) RORCRARGPPARG
SCHEMBL17978072 0.89 RORC (0.88) RORCRARGPPARG
SCHEMBL17977890 0.85 RORC (0.81) RORCPPARG
SCHEMBL17977741 0.85 RORC (0.78) RORC
SCHEMBL18019663 0.84 RORC (0.80) RORCPPARG
SCHEMBL17978374 0.84 RORC (0.80) RORCRARGPPARG
SCHEMBL18019631 0.83 RORC (0.78) RORCPPARG
SCHEMBL18019754 0.83 RORC (0.62) RORCRARGPPARG

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-2016128908-A1 BICYCLIC COMPOUNDS, COMPOSITIONS AND MEDICINAL APPLICATIONS THEREOF ADVINUS THERAPEUTICS LIMITED (IN) 2016-08-18 — — WO claimed
WO-2016128908-A1 BICYCLIC COMPOUNDS, COMPOSITIONS AND MEDICINAL APPLICATIONS THEREOF ADVINUS THERAPEUTICS LIMITED (IN) 2016-08-18 — — WO disclosed
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