SCHEMBL3817477

SCHEMBL3817477

CC(C)CC(O)(NCc1cc2nnccc2[nH]1)C(F)(F)F

nearest known ligand 0.45

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
NR3C1 P04150 2/20 0.45
NR3C2 P08235 2/20 0.45

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
SCHEMBL3948579 0.81 NR3C1 (0.61) NR3C1NR3C2
SCHEMBL3817481 0.77 NR3C1 (0.39) NR3C1NR3C2
SCHEMBL1930506 0.77 NR3C1 (0.75) NR3C1NR3C2
SCHEMBL4431838 0.76 CASR (0.48) NR3C1NR3C2
SCHEMBL1930980 0.74 NR3C1 (0.58) NR3C1NR3C2
SCHEMBL3825739 0.74 AAK1 (0.31) NR3C1NR3C2
SCHEMBL3811096 0.74 NR3C1 (0.42) NR3C1NR3C2
SCHEMBL3653860 0.72 NR3C1 (0.53) NR3C1NR3C2
SCHEMBL3826671 0.72 NR3C1 (0.45) NR3C1
SCHEMBL1932728 0.71 NR3C1 (0.56) NR3C1NR3C2

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-2086921-A2 SYNTHESIS OF SELECTED STEREOISOMERS OF CERTAIN SUBSTITUTED ALCOHOLS Bausch & Lomb Incorporated (US) 2009-08-12 EP disclosed
WO-2008060799-A2 SYNTHESIS OF SELECTED STEREOISOMERS OF CERTAIN SUBSTITUTED ALCOHOLS BAUSCH & LOMB INCORPORATED (US) 2008-05-22 WO disclosed