SCHEMBL8249159

SCHEMBL8249159

COC(=O)C1(c2ccc(N)cc2)CCCc2cncn21

nearest known ligand 0.48

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CYP11B2 P19099 5/20 0.48
CYP19A1 P11511 2/20 0.48
ADA P00813 1/20 0.35
POLB P06746 1/20 0.33
NR1H2 P55055 2/20 0.33
NR1H3 Q13133 2/20 0.33
BACE1 P56817 2/20 0.31
BACE2 Q9Y5Z0 2/20 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
SCHEMBL1037437 0.85 CYP19A1 (0.64) CYP11B2CYP19A1
SCHEMBL15348644 0.75 CYP11B2 (0.58) CYP11B2CYP19A1ADA
SCHEMBL2355664 0.74 CYP19A1 (0.60) CYP11B2CYP19A1
SCHEMBL1041429 0.72 CYP11B2 (0.60) CYP11B2CYP19A1BACE1BACE2
SCHEMBL1041634 0.66 CYP11B2 (0.81) CYP11B2CYP19A1
SCHEMBL2268465 0.65 HRH3 (0.46) POLB
SCHEMBL2267755 0.65 HRH3 (0.43) POLB
SCHEMBL1039271 0.65 CYP11B2 (1.00) CYP11B2CYP19A1BACE1BACE2
SCHEMBL1039095 0.65 CYP11B2 (1.00) CYP11B2CYP19A1
SCHEMBL12957226 0.65 CYP11B2 (0.72) CYP11B2CYP19A1

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-2270011-A1 Condensed imidazolo derivatives for the inhibition of aromatase Novartis AG (CH) 2011-01-05 EP disclosed
WO-2007024945-A1 CONDENSED IMIDAZOLO DERIVATIVES FOR THE INHIBITION OF ALDOSTERONE SYNTHASE AND AROMATASE NOVARTIS AG (CH) 2007-03-01 WO disclosed