SCHEMBL8260833

SCHEMBL8260833

COC(=O)C1=C(CCC2CC2)NC(C)=C(C#N)C1c1ccc(F)cc1C(F)(F)F

nearest known ligand 0.57

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
NR3C2 P08235 2/20 0.47

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
SCHEMBL8258559 0.89 NR3C2 (0.60) NR3C2
SCHEMBL8261160 0.89 NR3C2 (0.50) NR3C2
SCHEMBL13587785 0.89 NR3C2 (0.46) NR3C2
SCHEMBL8259769 0.88 NR3C2 (0.48) NR3C2
SCHEMBL8259186 0.88 NR3C2 (0.49) NR3C2
SCHEMBL8258517 0.87
SCHEMBL8260537 0.87 NR3C2 (0.47) NR3C2
SCHEMBL8259456 0.86 NR3C2 (0.46) NR3C2
SCHEMBL4377095 0.86 NR3C2 (0.49) NR3C2
SCHEMBL8259580 0.85 NR3C2 (0.45) NR3C2

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-2006066011-A2 COMPOUNDS AND COMPOSITIONS AS MODULATORS OF STEROIDAL RECEPTORS AND CALCIUM CHANNEL ACTIVITIES IRM LLC (BM) 2006-06-22 WO disclosed