SCHEMBL2447534

SCHEMBL2447534

CC(C)(C)OC(=O)NC1(c2ccc3c(C(F)(F)F)c(O)ccc3c2)COC(C)(C)OC1.CC(C)(C)OC(=O)NC1(c2ccc3c(C(F)(F)F)c(O)ccc3c2)COC(C)(C)OC1

nearest known ligand 0.31

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
RORC P51449 1/20 0.31

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
SCHEMBL2449275 1.00 RORC (0.31) RORC
SCHEMBL2454136 0.87 LMNA (0.32)
SCHEMBL2485565 0.82 ENPP2 (0.43)
SCHEMBL2779306 0.82 ENPP2 (0.43)
SCHEMBL2453736 0.82 ENPP2 (0.47)
SCHEMBL2480740 0.81 NQO2 (0.37) RORC
SCHEMBL2777166 0.79 ENPP2 (0.39)
SCHEMBL2777169 0.79 ENPP2 (0.39)
SCHEMBL2453428 0.78 HSD11B1 (0.40) RORC
SCHEMBL2521339 0.75 ENPP2 (0.42)

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
EP-2364088-A1 BICYCLIC ARYL SPHINGOSINE 1-PHOSPHATE ANALOGS Biogen Idec MA Inc. (US) 2011-09-14 EP disclosed
WO-2010051030-A1 BICYCLIC ARYL SPHINGOSINE 1-PHOSPHATE ANALOGS BIOGEN IDEC MA INC. (US) 2010-05-06 WO disclosed