SCHEMBL18479644

SCHEMBL18479644

CC[S+]([O-])c1ccc(C(CO)NC(=O)c2ccc3c(c2)nc(COC2CCC(C(F)(F)F)CC2)n3C2CC2)cc1

nearest known ligand 0.64

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ RORC P51449 20/20 0.64

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
SCHEMBL18479638 0.89 RORC (0.81) RORC
SCHEMBL18479639 0.89 RORC (0.81) RORC
SCHEMBL21750503 0.89 RORC (0.81) RORC
SCHEMBL22512543 0.88 RORC (0.64) RORC
SCHEMBL22512498 0.85 RORC (0.59) RORC
SCHEMBL21750500 0.78 RORC (1.00) RORC
SCHEMBL22490687 0.78 RORC (1.00) RORC
SCHEMBL21750526 0.78 RORC (1.00) RORC
SCHEMBL20454463 0.78 RORC (0.77) RORC
SCHEMBL21750578 0.77 RORC (0.88) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2017024018-A1 MODULATORS OF ROR-GAMMA VITAE PHARMACEUTICALS, INC. (US) 2017-02-09 — — WO disclosed
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