SCHEMBL7738308

SCHEMBL7738308

CCOC(=O)[C@H]1Cc2ccccc2CN1Cc1cncn1Cc1ccc(C#N)cc1

nearest known ligand 0.51

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
FNTA P49354 18/20 0.51
FNTB P49356 18/20 0.51
CYP11B1 P15538 2/20 0.51
CYP11B2 P19099 2/20 0.51
PGGT1B P53609 6/20 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
SCHEMBL7738301 1.00 FNTA (0.51) FNTAFNTBCYP11B1CYP11B2PGGT1B
SCHEMBL7744223 1.00 FNTA (0.51) FNTAFNTBCYP11B1CYP11B2PGGT1B
Hydrochloric Acid SCHEMBL7744220 0.99 FNTA (0.51) FNTAFNTBCYP11B1CYP11B2PGGT1B
Hydrochloric Acid SCHEMBL7738269 0.99 FNTA (0.51) FNTAFNTBCYP11B1CYP11B2PGGT1B
Hydrochloric Acid SCHEMBL7738264 0.99 FNTA (0.51) FNTAFNTBCYP11B1CYP11B2PGGT1B
SCHEMBL7744133 0.91 FNTA (0.47) FNTAFNTBCYP11B1CYP11B2PGGT1B
SCHEMBL7744139 0.91 FNTA (0.47) FNTAFNTBCYP11B1CYP11B2PGGT1B
Hydrochloric Acid SCHEMBL8483580 0.90 FNTA (0.46) FNTAFNTBCYP11B1CYP11B2PGGT1B
Hydrochloric Acid SCHEMBL8483577 0.90 FNTA (0.46) FNTAFNTBCYP11B1CYP11B2PGGT1B
SCHEMBL8479891 0.82 FNTA (0.53) FNTAFNTBPGGT1B

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