SCHEMBL7714035

SCHEMBL7714035

CC(C)(C)OC(=O)NC(C)(c1ccc(C#N)c(F)c1)c1cncn1CC(=O)NC1CCN(c2cccc3ccc(O)cc23)C1=O

nearest known ligand 0.38

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
FNTA P49354 11/20 0.38
FNTB P49356 11/20 0.38
KCNH2 Q12809 10/20 0.38
PGGT1B P53609 9/20 0.38
CYP3A4 P08684 3/20 0.38
FPR2 P25090 4/20 0.33
FPR1 P21462 3/20 0.33
KDM4D Q6B0I6 1/20 0.33
NQO2 P16083 1/20 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
SCHEMBL7714043 1.00 FNTA (0.38) FNTAFNTBKCNH2PGGT1BCYP3A4
SCHEMBL7714038 1.00 FNTA (0.38) FNTAFNTBKCNH2PGGT1BCYP3A4
SCHEMBL7714014 0.90 FNTA (0.41) FNTAFNTBKCNH2PGGT1BCYP3A4
SCHEMBL7714018 0.90 FNTA (0.41) FNTAFNTBKCNH2PGGT1BCYP3A4
SCHEMBL7714011 0.90 FNTA (0.41) FNTAFNTBKCNH2PGGT1BCYP3A4
Hydrochloric Acid SCHEMBL7717584 0.89 FNTA (0.40) FNTAFNTBKCNH2PGGT1BCYP3A4
Hydrochloric Acid SCHEMBL7717591 0.89 FNTA (0.40) FNTAFNTBKCNH2PGGT1BCYP3A4
Hydrochloric Acid SCHEMBL7717582 0.89 FNTA (0.40) FNTAFNTBKCNH2PGGT1BCYP3A4
SCHEMBL7717551 0.77 FNTA (0.46) FNTAFNTBKCNH2PGGT1BCYP3A4
SCHEMBL7717552 0.77 FNTA (0.46) FNTAFNTBKCNH2PGGT1BCYP3A4

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
US-6441017-B1 Inhibitors of prenyl-protein transferase MERCK & CO., INC. 2002-08-27 US disclosed