SCHEMBL7830749

SCHEMBL7830749

N#Cc1ccc(Cn2cncc2CN2CCC(CO)(Cc3cccc(OC(F)(F)F)c3)CC2)cc1

nearest known ligand 0.67

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
FNTA P49354 17/20 0.67
FNTB P49356 17/20 0.67
PGGT1B P53609 15/20 0.67
LMNA P02545 2/20 0.47
CYP11B1 P15538 1/20 0.46
CYP11B2 P19099 1/20 0.46
NRAS P01111 1/20 0.44
HRAS P01112 1/20 0.44

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
SCHEMBL7839218 0.91 FNTA (0.65) FNTAFNTBPGGT1BNRASHRAS
Hydrochloric Acid SCHEMBL7843273 0.90 FNTA (0.65) FNTAFNTBPGGT1BNRASHRAS
SCHEMBL7972496 0.88 NPSR1 (0.53) FNTAFNTBPGGT1BLMNACYP11B1
SCHEMBL7842402 0.86 FNTA (0.67) FNTAFNTBPGGT1BCYP11B1CYP11B2
SCHEMBL7842570 0.85 FNTA (0.63) FNTAFNTBPGGT1BCYP11B1CYP11B2
SCHEMBL7840263 0.84 FNTA (0.53) FNTAFNTBPGGT1BLMNA
Trifluoroacetic Acid SCHEMBL7974075 0.83 FNTA (0.64) FNTAFNTBPGGT1BCYP11B1CYP11B2
SCHEMBL7839464 0.82 FNTA (0.62) FNTAFNTBPGGT1BNRASHRAS
Hydrochloric Acid SCHEMBL7844275 0.81 FNTA (0.61) FNTAFNTBPGGT1BNRASHRAS
SCHEMBL7840862 0.81 FNTA (0.63) 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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0944388-A4 INHIBITORS OF FARNESYL-PROTEIN TRANSFERASE MERCK & CO INC (US) 2001-08-16 EP disclosed
US-6248756-B1 Inhibitors of farnesyl-protein transferase MERCK & CO., INC. 2001-06-19 US disclosed
WO-2000016778-A1 A METHOD OF TREATING CANCER MERCK & CO., INC. (US) 2000-03-30 WO disclosed
EP-0944388-A2 INHIBITORS OF FARNESYL-PROTEIN TRANSFERASE Merck & Co., Inc. (US) 1999-09-29 EP disclosed
WO-1997038665-A2 INHIBITORS OF FARNESYL-PROTEIN TRANSFERASE MERCK & CO., INC. (US) 1997-10-23 WO disclosed