SCHEMBL7839464

SCHEMBL7839464

N#Cc1ccc(Cn2cncc2CN2CCC3(CC2)CN(Cc2cccc(OC(F)(F)F)c2)C(=O)O3)cc1

nearest known ligand 0.62

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
FNTA P49354 18/20 0.62
FNTB P49356 18/20 0.62
PGGT1B P53609 12/20 0.62
NRAS P01111 1/20 0.45
HRAS P01112 1/20 0.45
KCNH2 Q12809 2/20 0.44
CYP3A4 P08684 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
Hydrochloric Acid SCHEMBL7844275 0.99 FNTA (0.61) FNTAFNTBPGGT1BNRASHRAS
SCHEMBL7833379 0.86 FNTA (0.62) FNTAFNTBPGGT1B
Hydrochloric Acid SCHEMBL7977774 0.85 FNTA (0.61) FNTAFNTBPGGT1B
SCHEMBL7841098 0.84 FNTA (0.49) FNTAFNTBPGGT1BNRASHRAS
Hydrochloric Acid SCHEMBL7992200 0.83 FNTA (0.48) FNTAFNTBPGGT1BNRASHRAS
SCHEMBL7842924 0.82 FNTA (0.60) FNTAFNTBPGGT1BNRASHRAS
SCHEMBL7830749 0.82 FNTA (0.67) FNTAFNTBPGGT1BNRASHRAS
SCHEMBL7840862 0.82 FNTA (0.63) FNTAFNTBPGGT1BNRASHRAS
Hydrochloric Acid SCHEMBL7843843 0.82 FNTA (0.59) FNTAFNTBPGGT1BNRASHRAS
Hydrochloric Acid SCHEMBL7839004 0.81 FNTA (0.62) 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 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1087770-A4 INHIBITORS OF PRENYL-PROTEIN TRANSFERASE MERCK & CO INC (US) 2001-11-14 EP claimed
EP-1087770-A1 INHIBITORS OF PRENYL-PROTEIN TRANSFERASE Merck & Co., Inc. (US) 2001-04-04 EP claimed
WO-1999065494-A1 INHIBITORS OF PRENYL-PROTEIN TRANSFERASE MERCK & CO., INC. (US) 1999-12-23 WO claimed
EP-1087770-A4 INHIBITORS OF PRENYL-PROTEIN TRANSFERASE MERCK & CO INC (US) 2001-11-14 EP disclosed
EP-1087770-A1 INHIBITORS OF PRENYL-PROTEIN TRANSFERASE Merck & Co., Inc. (US) 2001-04-04 EP disclosed
US-6172076-B1 HETEROCYCLE-SUBSTITUTED 1,3,8-TRIAZASPIRO(4,5)DECANE DERIVATIVES; TREATING ARTERIOSCLEROSIS MERCK & CO., INC. 2001-01-09 US disclosed
WO-1999065494-A1 INHIBITORS OF PRENYL-PROTEIN TRANSFERASE MERCK & CO., INC. (US) 1999-12-23 WO disclosed