SCHEMBL7981764

SCHEMBL7981764

CC(C)(Oc1c(F)cc(Cl)cc1F)c1nnc(-c2ccc(N)cc2F)n1C1CC1

nearest known ligand 0.55

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 1/20 0.33
ALDH1A1 P00352 1/20 0.32
HSD11B2 P80365 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
SCHEMBL7981581 0.93 HSD11B2 (0.38) HSD11B1HSD11B2
SCHEMBL7981848 0.92 ALDH1A1 (0.33) ALDH1A1
SCHEMBL7979711 0.88 HSD11B1 (0.36) HSD11B1ALDH1A1HSD11B2
SCHEMBL12671320 0.86 PARP1 (0.37) HSD11B1
SCHEMBL12671310 0.85 PDE4A (0.38)
SCHEMBL7981367 0.84 ALDH1A1 (0.33) ALDH1A1
SCHEMBL7982146 0.84 CYP11B1 (0.32) ALDH1A1
SCHEMBL7978100 0.83 HSD11B1 (0.33) HSD11B1ALDH1A1HSD11B2
SCHEMBL7980057 0.83 CYP11B1 (0.38)
SCHEMBL7992171 0.82 CYP11B1 (0.35) ALDH1A1

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-2298747-A1 TRIAZOLE DERIVATIVE OR SALT THEREOF Astellas Pharma Inc. (JP) 2011-03-23 EP disclosed
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