SCHEMBL7839628

SCHEMBL7839628

Cc1ccccc1N1CCC(Cn2cncc2Cc2ccc(C#N)cc2)CC1

nearest known ligand 0.45

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
FNTA P49354 17/20 0.45
FNTB P49356 17/20 0.45
CYP11B1 P15538 3/20 0.45
CYP11B2 P19099 3/20 0.45
PGGT1B P53609 8/20 0.42
CYP19A1 P11511 1/20 0.41
KCNH2 Q12809 1/20 0.41

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 SCHEMBL7974608 0.99 FNTA (0.45) FNTAFNTBCYP11B1CYP11B2PGGT1B
SCHEMBL7844153 0.86 FNTA (0.48) FNTAFNTBCYP11B1CYP11B2PGGT1B
Hydrochloric Acid SCHEMBL7847986 0.85 FNTA (0.48) FNTAFNTBCYP11B1CYP11B2PGGT1B
SCHEMBL7838564 0.79 CYP11B1 (0.48) FNTAFNTBCYP11B1CYP11B2PGGT1B
SCHEMBL8420978 0.77 FNTA (0.56) FNTAFNTBPGGT1BKCNH2
SCHEMBL7974315 0.76 GPR119 (0.48) FNTAFNTBCYP11B1CYP11B2PGGT1B
Hydrochloric Acid SCHEMBL8301027 0.76 FNTA (0.55) FNTAFNTBPGGT1BKCNH2
SCHEMBL7974242 0.75 FNTA (0.63) FNTAFNTBPGGT1BKCNH2
SCHEMBL7840789 0.74 KCNH2 (0.56) FNTAFNTBPGGT1BKCNH2
Hydrochloric Acid SCHEMBL7972916 0.74 FNTA (0.62) 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 6 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
US-6248756-B1 Inhibitors of farnesyl-protein transferase MERCK & CO., INC. 2001-06-19 US disclosed
US-5891889-A Inhibitors of farnesyl-protein transferase MERCK & CO., INC. (US) 1999-04-06 US disclosed