SCHEMBL8480799

SCHEMBL8480799

COc1ccc2c(c1)CCN(Cc1cncn1Cc1ccc(C#N)cc1)[C@H]2CCc1ccccc1

nearest known ligand 0.47

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
FNTA P49354 18/20 0.47
FNTB P49356 18/20 0.47
PGGT1B P53609 9/20 0.46
KCNH2 Q12809 1/20 0.43

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
SCHEMBL8481058 0.73 FNTA (0.51) FNTAFNTBPGGT1BKCNH2
SCHEMBL8481062 0.73 FNTA (0.51) FNTAFNTBPGGT1BKCNH2
Hydrochloric Acid SCHEMBL8483237 0.72 FNTA (0.51) FNTAFNTBPGGT1BKCNH2
Hydrochloric Acid SCHEMBL8483232 0.72 FNTA (0.51) FNTAFNTBPGGT1BKCNH2
SCHEMBL7743501 0.68 FNTA (0.54) FNTAFNTBPGGT1B
SCHEMBL8141157 0.68 FNTA (0.72) FNTAFNTBPGGT1B
SCHEMBL7743768 0.67 FNTA (0.66) FNTAFNTBPGGT1B
SCHEMBL7744106 0.67 FNTA (0.60) FNTAFNTBPGGT1BKCNH2
Hydrochloric Acid SCHEMBL7746020 0.66 FNTA (0.59) FNTAFNTBPGGT1BKCNH2
Hydrochloric Acid SCHEMBL7738189 0.66 FNTA (0.64) 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-5977134-A Inhibitors of farnesyl-protein transferase MERCK & CO., INC. (US) 1999-11-02 US disclosed