SCHEMBL7956016

SCHEMBL7956016

CCC1(c2cccc(Oc3cc(Cn4ccnc4C)ccc3C#N)c2)CCCCN(C)C1=O.CC[C@]1(c2cccc(Oc3cc(Cn4ccnc4)ccc3C#N)c2)CCCCN(C)C1=O

nearest known ligand 0.87

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
FNTA P49354 20/20 0.87
FNTB P49356 20/20 0.87
PGGT1B P53609 20/20 0.87

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
SCHEMBL7956015 1.00 FNTA (0.87) FNTAFNTBPGGT1B
SCHEMBL3499719 0.94 FNTA (0.75) FNTAFNTBPGGT1B
SCHEMBL3500996 0.93 FNTA (1.00) FNTAFNTBPGGT1B
SCHEMBL7674342 0.93 FNTA (1.00) FNTAFNTBPGGT1B
SCHEMBL7674338 0.93 FNTA (1.00) FNTAFNTBPGGT1B
Hydrochloric Acid SCHEMBL7674697 0.93 FNTA (0.98) FNTAFNTBPGGT1B
SCHEMBL3502431 0.91 FNTA (0.96) FNTAFNTBPGGT1B
SCHEMBL3501501 0.87 FNTA (0.88) FNTAFNTBPGGT1B
SCHEMBL3502000 0.86 FNTA (0.86) FNTAFNTBPGGT1B
Hydrochloric Acid SCHEMBL7673727 0.86 FNTA (0.86) FNTAFNTBPGGT1B

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-6284755-B1 Inhibitors of prenyl-protein transferase MERCK & CO., INC. 2001-09-04 US disclosed