SCHEMBL7979290

SCHEMBL7979290

C[C@H](Oc1ccc(N)cc1Br)c1nnc(-c2ccccc2C(F)(F)F)n1C

nearest known ligand 0.52

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 20/20 0.52

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
SCHEMBL7979418 0.89 HSD11B1 (0.50) HSD11B1
SCHEMBL7982107 0.88 HSD11B1 (0.52) HSD11B1
SCHEMBL7984076 0.86 HSD11B1 (0.47) HSD11B1
SCHEMBL12671010 0.85 HSD11B1 (0.49) HSD11B1
SCHEMBL7977558 0.85 HSD11B1 (0.49) HSD11B1
SCHEMBL7984121 0.84 HSD11B1 (0.50) HSD11B1
SCHEMBL7983827 0.84 HSD11B1 (0.51) HSD11B1
SCHEMBL7981282 0.83 HSD11B1 (0.56) HSD11B1
SCHEMBL7970923 0.82 HSD11B1 (0.55) HSD11B1
SCHEMBL7984577 0.82 HSD11B1 (0.55) HSD11B1

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-2010001946-A1 TRIAZOLE DERIVATIVE OR SALT THEREOF アステラス製薬株式会社 (JP) 2010-01-07 WO disclosed