SCHEMBL7666563

SCHEMBL7666563

NC(=O)c1cncc(C[O])c1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP11B1 P15538 2/20 0.49
CYP11B2 P19099 2/20 0.49
SIRT2 Q8IXJ6 8/20 0.42
SIRT3 Q9NTG7 8/20 0.42
SIRT1 Q96EB6 7/20 0.42
F7 P08709 1/20 0.42
F3 P13726 1/20 0.42
SARM1 Q6SZW1 1/20 0.42
SIRT6 Q8N6T7 1/20 0.42
SIRT5 Q9NXA8 1/20 0.42
SIRT4 Q9Y6E7 1/20 0.42
MKNK1 Q9BUB5 4/20 0.42
MKNK2 Q9HBH9 4/20 0.42
RAF1 P04049 1/20 0.40
PKMYT1 Q99640 1/20 0.40
CHRNB2 P17787 1/20 0.39
CHRNA4 P43681 1/20 0.39
MAP4K4 O95819 1/20 0.39
KDM4E B2RXH2 2/20 0.38
MEN1 O00255 1/20 0.38

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
SCHEMBL509510 0.84 CYP11B2 (0.49) CYP11B1CYP11B2SIRT2SIRT3SIRT1
SCHEMBL18340498 0.84 CYP11B2 (0.49) CYP11B1CYP11B2SIRT2SIRT3SIRT1
SCHEMBL31046827 0.82 SMYD3 (0.52) CYP11B1CYP11B2SIRT2SIRT3SIRT1
SCHEMBL28999567 0.82 CYP11B1 (0.48) CYP11B1CYP11B2SIRT2SIRT3SIRT1
SCHEMBL9607829 0.82 SMYD3 (0.52) CYP11B1CYP11B2SIRT2SIRT3SIRT1
SCHEMBL7674347 0.82 HCAR2 (0.53) CYP11B1CYP11B2MKNK1MKNK2RAF1
SCHEMBL30827012 0.81 CYP11B1 (0.47) CYP11B1CYP11B2SIRT2SIRT3SIRT1
Hydrochloric Acid SCHEMBL29793528 0.81 SMYD3 (0.51) CYP11B1CYP11B2SIRT2SIRT3SIRT1
SCHEMBL2841794 0.80 SIRT2 (0.54) CYP11B1CYP11B2SIRT2SIRT3SIRT1
SCHEMBL24252516 0.78 CYP11B1 (0.45) CYP11B1CYP11B2SIRT2SIRT3SIRT1

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
US-6476021-B1 Compounds having cGMP-PDE inhibitory effect MOCHIDA PHARMACEUTICAL CO., LTD. (JP) 2002-11-05 US disclosed
CN-1284075-A Novel compounds having CGMP-PDE inhibitory effect MOCHIDA PHARM CO LTD (JP) 2001-02-14 CN disclosed
EP-1048666-A1 NOVEL COMPOUNDS HAVING cGMP-PDE INHIBITORY EFFECT MOCHIDA PHARMACEUTICAL CO., LTD. (JP) 2000-11-02 EP disclosed