SCHEMBL8194239

SCHEMBL8194239

CC[C@]1(c2cccc(Oc3cc(C(N)Cc4cncn4C)ccc3C#N)c2)CCCCN(CCOC)C1=O

nearest known ligand 0.66

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
FNTA P49354 20/20 0.66
FNTB P49356 20/20 0.66
PGGT1B P53609 20/20 0.66

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
SCHEMBL8186113 0.94 FNTA (0.69) FNTAFNTBPGGT1B
SCHEMBL8197892 0.94 FNTA (0.68) FNTAFNTBPGGT1B
SCHEMBL8195493 0.92 FNTA (0.66) FNTAFNTBPGGT1B
SCHEMBL8195441 0.92 FNTA (0.66) FNTAFNTBPGGT1B
SCHEMBL8156854 0.91 FNTA (0.80) FNTAFNTBPGGT1B
SCHEMBL8194175 0.90 FNTA (0.63) FNTAFNTBPGGT1B
Trifluoroacetic Acid SCHEMBL8193521 0.87 FNTA (0.62) FNTAFNTBPGGT1B
SCHEMBL8186979 0.85 FNTA (0.70) FNTAFNTBPGGT1B
SCHEMBL8198211 0.84 FNTA (0.70) FNTAFNTBPGGT1B
SCHEMBL3696042 0.83 FNTA (0.80) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2000034437-A2 INHIBITORS OF PRENYL-PROTEIN TRANSFERASE MERCK & CO., INC. (US) 2000-06-15 WO claimed
WO-2000034437-A2 INHIBITORS OF PRENYL-PROTEIN TRANSFERASE MERCK & CO., INC. (US) 2000-06-15 WO disclosed