SCHEMBL19059299

SCHEMBL19059299

CC1(C)CCCc2ncncc2CC1

nearest known ligand 0.36

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
CYP11B2 P19099 1/20 0.36
HDAC9 Q9UKV0 1/20 0.32

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
SCHEMBL19059295 0.93 CYP11B2 (0.36) CYP11B2HDAC9
SCHEMBL15492413 0.90 CYP11B2 (0.36) CYP11B2HDAC9
SCHEMBL15492457 0.88 CYP11B2 (0.36) CYP11B2HDAC9
SCHEMBL19059004 0.88 HDAC9 (0.36) CYP11B2HDAC9
SCHEMBL19059003 0.82 CYP11B2 (0.40) CYP11B2HDAC9
SCHEMBL9538975 0.79 HDAC9 (0.41) CYP11B2HDAC9
SCHEMBL35277 0.77
SCHEMBL29460883 0.77 SIGMAR1 (0.43) CYP11B2HDAC9
SCHEMBL29438246 0.77
SCHEMBL556889 0.77 SIGMAR1 (0.43) CYP11B2HDAC9

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
EP-2693882-B1 SUBSTITUTED CYCLOPROPYL COMPOUNDS, COMPOSITIONS CONTAINING SUCH COMPOUNDS AND METHODS OF TREATMENT MERCK SHARP & DOHME (US) 2017-06-28 EP disclosed