SCHEMBL7755895

SCHEMBL7755895

CCOC(C=O)Oc1c[c]c(F)cc1C#N

nearest known ligand 0.33

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
CYP11B1 P15538 1/20 0.30
CYP11B2 P19099 1/20 0.30

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
SCHEMBL5843335 0.75 CYP11B1 (0.39) CYP11B1CYP11B2
SCHEMBL8894827 0.75
SCHEMBL6593244 0.75 MAPT (0.38)
SCHEMBL6588915 0.74 LMNA (0.31)
SCHEMBL5843345 0.70 ALDH1A1 (0.44)
SCHEMBL5842046 0.69 ALDH1A1 (0.35)
SCHEMBL5844366 0.69 AR (0.33) CYP11B1CYP11B2
SCHEMBL5842676 0.69 XDH (0.41)
SCHEMBL5841619 0.68 NLRP3 (0.43)
SCHEMBL5842236 0.68 TSHR (0.32) CYP11B1CYP11B2

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1070055-A1 SUBSTITUTED PHENYL PYRIDAZINONES Bayer Aktiengesellschaft (DE) 2001-01-24 EP disclosed
WO-2000008000-A1 USE OF SUBSTITUTED TRIAZINONES AS HERBICIDES BAYER AKTIENGESELLSCHAFT (DE) 2000-02-17 WO disclosed
WO-1999052878-A1 SUBSTITUTED PHENYL PYRIDAZINONES BAYER AKTIENGESELLSCHAFT (DE) 1999-10-21 WO disclosed