SCHEMBL8149148

SCHEMBL8149148

N#Cc1ccc(Cc2cn(C(c3ccccc3)(c3ccccc3)c3ccccc3)cn2)cc1C#N

nearest known ligand 0.39

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
SIRT2 Q8IXJ6 13/20 0.39
MAOB P27338 3/20 0.37
MAOA P21397 2/20 0.35
CYP19A1 P11511 2/20 0.33
FNTA P49354 1/20 0.33
FNTB P49356 1/20 0.33
PGGT1B P53609 1/20 0.33
ENPP2 Q13822 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
SCHEMBL7677947 0.90 SIRT2 (0.39) SIRT2
SCHEMBL8155410 0.89 CYP19A1 (0.47) SIRT2CYP19A1FNTAFNTBPGGT1B
SCHEMBL8157361 0.89 CYP19A1 (0.47) SIRT2CYP19A1
SCHEMBL8155533 0.87 FNTA (0.41) SIRT2FNTAFNTBPGGT1B
SCHEMBL8150875 0.84 FNTA (0.39) SIRT2FNTAFNTBPGGT1B
SCHEMBL2787690 0.84 CYP19A1 (0.40) SIRT2MAOBCYP19A1
SCHEMBL7669884 0.83 SIRT2 (0.40) SIRT2CYP19A1
SCHEMBL5688738 0.77 SIRT2 (0.46) SIRT2ENPP2
SCHEMBL7675181 0.77 SIRT2 (0.41) SIRT2MAOBENPP2
SCHEMBL7663646 0.77 L3MBTL1 (0.45) SIRT2MAOBMAOAENPP2

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6077853-A Inhibitors of farnesyl-protein transferase MERCK & CO., INC. (US) 2000-06-20 US disclosed
EP-0951285-A1 INHIBITORS OF FARNESYL-PROTEIN TRANSFERASE Merck & Co., Inc. (US) 1999-10-27 EP disclosed
US-5939439-A Inhibitors of farnesyl-protein transferase MERCK & CO., INC. (US) 1999-08-17 US disclosed
WO-1998029119-A1 INHIBITORS OF FARNESYL-PROTEIN TRANSFERASE MERCK & CO., INC. (US) 1998-07-09 WO disclosed