SCHEMBL15569730

SCHEMBL15569730

O=C(O)C1CC2CCCC(C1)N2c1nn(C(=O)c2c(Cl)cccc2C(F)(F)F)c2cccc(F)c12

nearest known ligand 0.93

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
RORC P51449 20/20 0.93

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
SCHEMBL16968521 1.00 RORC (0.93) RORC
SCHEMBL15569732 1.00 RORC (0.93) RORC
SCHEMBL15568615 0.96 RORC (1.00) RORC
SCHEMBL15569678 0.86 RORC (0.81) RORC
SCHEMBL16979529 0.84 RORC (0.77) RORC
SCHEMBL15566682 0.84 RORC (1.00) RORC
SCHEMBL15566221 0.82 RORC (1.00) RORC
SCHEMBL16968508 0.82 RORC (1.00) RORC
SCHEMBL15569287 0.82 RORC (0.75) RORC
SCHEMBL15570136 0.81 RORC (1.00) RORC

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2920149-B1 3-AMINOCYCLOALKYL COMPOUNDS AS ROR-GAMMA-T INHIBITORS AND USES THEREOF MERCK SHARP & DOHME (US) 2019-03-20 EP claimed
EP-2920149-A2 3-AMINOCYCLOALKYL COMPOUNDS AS RORgammaT INHIBITORS AND USES THEREOF Merck Sharp & Dohme Corp. (US) 2015-09-23 EP disclosed
WO-2014028600-A2 3-AMINOCYCLOALKYL COMPOUNDS AS RORgammaT INHIBITORS AND USES THEREOF MERCK SHARP & DOHME CORP. (US) 2014-02-20 WO disclosed