SCHEMBL7166983

SCHEMBL7166983

N#Cc1ccc(Cn2cncc2CN2CCN(Cc3cccc(O)c3)C(=O)C2)cc1F

nearest known ligand 0.51

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
FNTA P49354 20/20 0.51
FNTB P49356 16/20 0.51
PGGT1B P53609 16/20 0.51
NRAS P01111 1/20 0.50
HRAS P01112 1/20 0.50

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
SCHEMBL7163417 0.82 FNTA (0.45) FNTAFNTBPGGT1BNRASHRAS
SCHEMBL7164727 0.82 FNTA (0.48) FNTAFNTBPGGT1BNRASHRAS
SCHEMBL7718965 0.81 FNTA (0.66) FNTAFNTBPGGT1B
SCHEMBL7718963 0.81 FNTA (0.66) FNTAFNTBPGGT1B
SCHEMBL7532831 0.80 FNTA (0.78) FNTAFNTBPGGT1BNRASHRAS
Hydrochloric Acid SCHEMBL7653563 0.79 FNTA (0.77) FNTAFNTBPGGT1BNRASHRAS
SCHEMBL6434433 0.79 FNTA (0.45) FNTAFNTBPGGT1BNRASHRAS
Trifluoroacetic Acid SCHEMBL7166202 0.79 FNTA (0.52) FNTAFNTBPGGT1BNRASHRAS
SCHEMBL6471063 0.78 FNTA (0.53) FNTAFNTBPGGT1BNRASHRAS
SCHEMBL7163856 0.77 FNTA (0.48) FNTAFNTBPGGT1BNRASHRAS

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
US-6562823-B1 Inhibition of farnesyl-protein transferase has been shown to block the growth of Ras-transformed cells in soft agar MERCK & CO., INC. 2003-05-13 US disclosed
WO-2000016778-A1 A METHOD OF TREATING CANCER MERCK & CO., INC. (US) 2000-03-30 WO disclosed