SCHEMBL14540792

SCHEMBL14540792

CC(C)(C)C1=NN(C(=O)c2ccc(Cl)cc2)C(c2ccccc2)C1

nearest known ligand 0.61

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ PDE5A O76074 9/20 0.61
▸ CA1 P00915 2/20 0.53
▸ CA2 P00918 2/20 0.53
▸ CA9 Q16790 1/20 0.53
▸ MAOA P21397 2/20 0.50
▸ PRKCZ Q05513 2/20 0.50
▸ MEN1 O00255 2/20 0.50
▸ KMT2A Q03164 2/20 0.50
▸ MAOB P27338 1/20 0.50
▸ RIPK1 Q13546 1/20 0.48

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
SCHEMBL25369066 0.83 PDE5A (0.64) PDE5AMAOAPRKCZMAOBRIPK1
SCHEMBL14541148 0.81 PDE5A (0.60) PDE5ACA1CA2CA9MAOA
SCHEMBL14540797 0.80 PDE5A (0.60) PDE5APRKCZMAOBRIPK1
SCHEMBL14540791 0.79 RIPK1 (0.74) PDE5APRKCZRIPK1
SCHEMBL14541221 0.79 PDE5A (0.64) PDE5APRKCZMEN1KMT2A
SCHEMBL14540882 0.78 CA1 (0.81) CA1CA2CA9MAOAMEN1
SCHEMBL12494514 0.76 PDE5A (1.00) PDE5APRKCZ
SCHEMBL14541083 0.75 CA1 (0.74) CA1CA2CA9MAOAMEN1
SCHEMBL14540883 0.75 CA1 (0.78) CA1CA2CA9MAOAMEN1
SCHEMBL15803417 0.74 PRKCZ (0.76) PDE5APRKCZ

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-2007038425-A2 ANTI-VIRAL COMPOUINDS REGENTS OF THE UNIVERSITY OF MINNESOTA (US) 2007-04-05 — — WO disclosed
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