SCHEMBL7832408

SCHEMBL7832408

N#Cc1ccc(Cc2cncn2CC2CCN(S(=O)(=O)c3cccc(Cl)c3)CC2)cc1

nearest known ligand 0.47

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
FNTA P49354 14/20 0.47
FNTB P49356 14/20 0.47
PGGT1B P53609 5/20 0.47
KCNH2 Q12809 4/20 0.47
CYP3A4 P08684 1/20 0.47
NRAS P01111 1/20 0.46
HRAS P01112 1/20 0.46
GPR6 P46095 1/20 0.44
CNR1 P21554 1/20 0.42

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 SCHEMBL7970645 0.99 FNTA (0.47) FNTAFNTBPGGT1BKCNH2CYP3A4
SCHEMBL7840789 0.83 KCNH2 (0.56) FNTAFNTBPGGT1BKCNH2CYP3A4
Hydrochloric Acid SCHEMBL7972342 0.82 KCNH2 (0.55) FNTAFNTBPGGT1BKCNH2CYP3A4
SCHEMBL7831743 0.82 FNTA (0.64) FNTAFNTBPGGT1BKCNH2CYP3A4
Hydrochloric Acid SCHEMBL7972613 0.81 FNTA (0.64) FNTAFNTBPGGT1BKCNH2CYP3A4
SCHEMBL7974242 0.76 FNTA (0.63) FNTAFNTBPGGT1BKCNH2
Hydrochloric Acid SCHEMBL7972916 0.75 FNTA (0.62) FNTAFNTBPGGT1BKCNH2
SCHEMBL7844153 0.75 FNTA (0.48) FNTAFNTBPGGT1BKCNH2
Hydrochloric Acid SCHEMBL7847986 0.75 FNTA (0.48) FNTAFNTBPGGT1BKCNH2
SCHEMBL7838564 0.74 CYP11B1 (0.48) 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 9 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 claimed
US-6248756-B1 Inhibitors of farnesyl-protein transferase MERCK & CO., INC. 2001-06-19 US claimed
EP-0944388-A2 INHIBITORS OF FARNESYL-PROTEIN TRANSFERASE Merck & Co., Inc. (US) 1999-09-29 EP claimed
WO-1997038665-A2 INHIBITORS OF FARNESYL-PROTEIN TRANSFERASE MERCK & CO., INC. (US) 1997-10-23 WO 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
US-5891889-A Inhibitors of farnesyl-protein transferase MERCK & CO., INC. (US) 1999-04-06 US disclosed
WO-1997038665-A2 INHIBITORS OF FARNESYL-PROTEIN TRANSFERASE MERCK & CO., INC. (US) 1997-10-23 WO disclosed