SCHEMBL7843523

SCHEMBL7843523

N#Cc1ccc(Cn2cncc2CCNC2CCN(c3ccccc3)CC2)cc1

nearest known ligand 0.69

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
FNTA P49354 19/20 0.69
FNTB P49356 19/20 0.69
PGGT1B P53609 15/20 0.69
KCNH2 Q12809 1/20 0.54
CYP11B1 P15538 1/20 0.51
CYP11B2 P19099 1/20 0.51

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 SCHEMBL7840117 0.99 FNTA (0.68) FNTAFNTBPGGT1BKCNH2CYP11B1
SCHEMBL7848543 0.90 FNTA (0.68) FNTAFNTBPGGT1BKCNH2
Hydrochloric Acid SCHEMBL7839383 0.89 FNTA (0.67) FNTAFNTBPGGT1BKCNH2
Hydrochloric Acid SCHEMBL7841805 0.85 FNTA (0.62) FNTAFNTBPGGT1BKCNH2
SCHEMBL7838156 0.85 FNTA (0.59) FNTAFNTBPGGT1BKCNH2CYP11B1
Hydrochloric Acid SCHEMBL7838838 0.84 FNTA (0.58) FNTAFNTBPGGT1BKCNH2CYP11B1
SCHEMBL8437091 0.84 FNTA (0.61) FNTAFNTBPGGT1BKCNH2
Hydrochloric Acid SCHEMBL8441943 0.83 FNTA (0.60) FNTAFNTBPGGT1BKCNH2
SCHEMBL8437095 0.82 FNTA (0.54) FNTAFNTBPGGT1BKCNH2
SCHEMBL7842568 0.82 FNTA (0.66) FNTAFNTBPGGT1BKCNH2

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
US-6248756-B1 Inhibitors of farnesyl-protein transferase MERCK & CO., INC. 2001-06-19 US claimed
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
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