SCHEMBL7744284

SCHEMBL7744284

N#Cc1ccc(Cn2cncc2CC(=O)N2CCc3ccc(Br)cc3C2)cc1

nearest known ligand 0.58

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
FNTA P49354 11/20 0.58
FNTB P49356 11/20 0.58
PGGT1B P53609 8/20 0.58
CYP11B1 P15538 6/20 0.49
CYP11B2 P19099 6/20 0.49
KCNH2 Q12809 2/20 0.46
NPC1 O15118 1/20 0.45
RAB9A P51151 1/20 0.45

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 SCHEMBL8479762 0.99 FNTA (0.57) FNTAFNTBPGGT1BCYP11B1CYP11B2
SCHEMBL7744226 0.84 FNTA (0.54) FNTAFNTBPGGT1BCYP11B1CYP11B2
SCHEMBL7744148 0.80 FNTA (0.54) FNTAFNTBPGGT1BCYP11B1CYP11B2
SCHEMBL7046791 0.76 FNTA (0.64) FNTAFNTBPGGT1BKCNH2
SCHEMBL7738240 0.76 FNTA (0.57) FNTAFNTBPGGT1BCYP11B1CYP11B2
Hydrochloric Acid SCHEMBL7744209 0.75 FNTA (0.56) FNTAFNTBPGGT1BCYP11B1CYP11B2
SCHEMBL7047035 0.74 FNTA (1.00) FNTAFNTBPGGT1B
SCHEMBL2786255 0.73 CYP11B1 (0.71) FNTAFNTBPGGT1BCYP11B1CYP11B2
SCHEMBL8487144 0.73 PRKAA2 (0.53) FNTAFNTBPGGT1BCYP11B1CYP11B2
SCHEMBL7738283 0.72 FNTA (0.54) FNTAFNTBPGGT1BCYP11B1CYP11B2

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-5977134-A Inhibitors of farnesyl-protein transferase MERCK & CO., INC. (US) 1999-11-02 US claimed
EP-1045843-A4 INHIBITORS OF FARNESYL-PROTEIN TRANSFERASE MERCK & CO INC (US) 2001-10-24 EP disclosed
EP-1045843-A1 INHIBITORS OF FARNESYL-PROTEIN TRANSFERASE Merck & Co., Inc. (US) 2000-10-25 EP disclosed
US-5977134-A Inhibitors of farnesyl-protein transferase MERCK & CO., INC. (US) 1999-11-02 US disclosed
WO-1999028313-A1 INHIBITORS OF FARNESYL-PROTEIN TRANSFERASE MERCK & CO., INC. (US) 1999-06-10 WO disclosed