SCHEMBL7673750

SCHEMBL7673750

CNC(C)(c1ccc(C#N)c(F)c1)c1cncn1C

nearest known ligand 0.44

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
FNTA P49354 15/20 0.44
FNTB P49356 15/20 0.44
PGGT1B P53609 15/20 0.44
CYP11B1 P15538 3/20 0.38
CYP11B2 P19099 3/20 0.38
S1PR1 P21453 1/20 0.37
S1PR3 Q99500 1/20 0.37
CYP17A1 P05093 1/20 0.37
CYP3A4 P08684 1/20 0.37

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
SCHEMBL7672909 0.83 CYP17A1 (0.48) FNTAFNTBPGGT1BCYP11B1CYP11B2
SCHEMBL7222091 0.83 FNTA (0.47) FNTAFNTBPGGT1BCYP11B1CYP11B2
Hydrochloric Acid SCHEMBL7220321 0.83 FNTA (0.41) FNTAFNTBPGGT1BS1PR1S1PR3
SCHEMBL7736904 0.82 S1PR3 (0.42) FNTAFNTBPGGT1BCYP11B1CYP11B2
Hydrochloric Acid SCHEMBL7220637 0.82 FNTA (0.47) FNTAFNTBPGGT1BCYP11B1CYP11B2
SCHEMBL7228124 0.81 CYP11B1 (0.36) FNTAFNTBPGGT1BCYP11B1CYP11B2
SCHEMBL7222226 0.78 FNTA (0.41) FNTAFNTBPGGT1BS1PR1S1PR3
SCHEMBL7222612 0.78 CYP11B1 (0.34) FNTAFNTBPGGT1BCYP11B1CYP11B2
SCHEMBL7241410 0.77 FNTA (0.42) FNTAFNTBPGGT1BS1PR1S1PR3
SCHEMBL7236823 0.75 FNTA (0.42) 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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20020037888-A1 4-imidazol-1-ylmethyl-2-(2-(2-oxo-piperidin-1-yl)-phenoxy) -benzonitrile for example; farnesyl-protein transferase inhibitors; treating cancer, benign proliferative disorder, hepatitis virus, restenosis, and polycystic kidney disease MERCK & CO., INC. 2002-03-28 US disclosed
US-6284755-B1 Inhibitors of prenyl-protein transferase MERCK & CO., INC. 2001-09-04 US disclosed
WO-2000034437-A2 INHIBITORS OF PRENYL-PROTEIN TRANSFERASE MERCK & CO., INC. (US) 2000-06-15 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20020037888-A1 4-imidazol-1-ylmethyl-2-(2-(2-oxo-piperidin-1-yl)-phenoxy) -benzonitrile for example; farnesyl-protein transferase inhibitors; treating cancer, benign proliferative disorder, hepatitis virus, restenosis, and polycystic kidney disease FNTA, PKD1, FNTB FNTA 1/4885FNTB 3/4885PGGT1B 256/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.