SCHEMBL7920328

SCHEMBL7920328

CCC1=N[C@]2(CCc3c(cccc3-c3cncnc3)C2)CN1

nearest known ligand 0.35

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
CYP11B1 P15538 2/20 0.33
CYP11B2 P19099 2/20 0.33
CYP19A1 P11511 1/20 0.33

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
SCHEMBL7927682 1.00 CYP11B1 (0.33) CYP11B1CYP11B2CYP19A1
SCHEMBL7924554 0.85 CYP11B1 (0.33) CYP11B1CYP11B2CYP19A1
SCHEMBL7925882 0.85 CYP11B1 (0.33) CYP11B1CYP11B2CYP19A1
SCHEMBL7916694 0.85 CYP11B1 (0.33) CYP11B1CYP11B2CYP19A1
SCHEMBL7926870 0.83 CYP11B1 (0.33) CYP11B1CYP11B2
SCHEMBL7918284 0.83 CYP11B1 (0.33) CYP11B1CYP11B2
SCHEMBL7916818 0.83 CYP11B1 (0.33) CYP11B1CYP11B2
SCHEMBL7924617 0.83 CYP11B1 (0.31) CYP11B1CYP11B2
SCHEMBL7929235 0.81 CYP11B1 (0.34) CYP11B1CYP11B2CYP19A1
SCHEMBL7926443 0.79 ADRA2A (0.30)

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-2010042473-A1 BIARYL SPIROAMINOOXAZOLINE ANALOGUES AS ALPHA2C ADRENERGIC RECEPTOR MODULATORS SCHERING CORPORATION (US) 2010-04-15 WO disclosed