SCHEMBL7220168

SCHEMBL7220168

COc1cccc(S(=O)(=O)NCCC(=O)NC(C#CC2CC2)(c2ccc(C#N)c(F)c2)c2cncn2C)c1

nearest known ligand 0.37

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
FNTA P49354 11/20 0.37
FNTB P49356 11/20 0.37
PGGT1B P53609 7/20 0.37
LMNA P02545 2/20 0.35
ALDH1A1 P00352 1/20 0.35
POLB P06746 1/20 0.35
MEP1B Q16820 1/20 0.34
L3MBTL1 Q9Y468 2/20 0.33
ATM Q13315 1/20 0.33
TRPV4 Q9HBA0 1/20 0.33

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
SCHEMBL7220418 0.86 ALDH1A1 (0.40) FNTAFNTBPGGT1BLMNAALDH1A1
SCHEMBL7754941 0.74 TRPV4 (0.39) FNTAFNTBPGGT1BLMNAALDH1A1
SCHEMBL7754946 0.74 L3MBTL1 (0.40) FNTAFNTBPGGT1BMEP1BL3MBTL1
SCHEMBL7236823 0.72 FNTA (0.42) FNTAFNTBPGGT1B
SCHEMBL7698892 0.71 MAPT (0.42) FNTAFNTBPGGT1BLMNAALDH1A1
SCHEMBL6003410 0.71 MAPT (0.42) FNTAFNTBPGGT1BLMNAALDH1A1
SCHEMBL7227924 0.70 TRPV4 (0.34) FNTAFNTBPGGT1BTRPV4
SCHEMBL7681015 0.69 L3MBTL1 (0.39) ALDH1A1MEP1BL3MBTL1TRPV4
SCHEMBL7228470 0.68 TRPV4 (0.35) FNTAFNTBPGGT1BTRPV4
SCHEMBL7222558 0.68 S1PR3 (0.37) 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-6525074-B2 Peptidomimetic macrocyclic compounds which inhibit prenyl-protein transferase and the prenylation of the oncogene protein Ras MERCK & CO., INC. 2003-02-25 US disclosed
US-20020049217-A1 Inhibitors of prenyl-protein transferase MERCK SHARP & DOHME CORP. 2002-04-25 US disclosed
WO-2001051126-A1 INHIBITORS OF PRENYL-PROTEIN TRANSFERASE MERCK & CO., INC. (US) 2001-07-19 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-20020049217-A1 Inhibitors of prenyl-protein transferase FNTA, KRAS, NRAS FNTA 1/4885FNTB 5/4885PGGT1B 122/4885

“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.