SCHEMBL6412093

SCHEMBL6412093

N#Cc1ccc(CC(c2cnc[nH]2)N2CCN(c3cccc4ccc(OC(=O)C(F)(F)F)cc34)C(=O)C2)cc1F

nearest known ligand 0.35

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
FNTA P49354 12/20 0.35
PGGT1B P53609 10/20 0.35
FNTB P49356 10/20 0.35
DNAJA1 P31689 1/20 0.35
GPR52 Q9Y2T5 1/20 0.31
KCNH2 Q12809 6/20 0.31
HTR1A P08908 1/20 0.31
HTR1D P28221 1/20 0.31
HTR1B P28222 1/20 0.31
CYP3A4 P08684 2/20 0.31

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
SCHEMBL6416010 0.95 FNTA (0.33) FNTAPGGT1BFNTBDNAJA1GPR52
SCHEMBL7166236 0.87 FNTA (0.37) FNTAPGGT1BFNTBDNAJA1GPR52
SCHEMBL6410659 0.85 FNTA (0.33) FNTAPGGT1BFNTB
SCHEMBL6416690 0.82 FNTA (0.34) FNTAPGGT1BFNTB
SCHEMBL7165181 0.82 FNTA (0.37) FNTAPGGT1BFNTBDNAJA1GPR52
SCHEMBL7166206 0.78 FNTA (0.54) FNTAPGGT1BFNTB
SCHEMBL7532834 0.77 FNTA (0.43) FNTAPGGT1BFNTB
SCHEMBL6411741 0.77 FNTA (0.34) FNTAPGGT1BFNTBDNAJA1GPR52
Hydrochloric Acid SCHEMBL7653568 0.76 FNTA (0.42) FNTAPGGT1BFNTB
Trifluoroacetic Acid SCHEMBL6410657 0.76 FNTA (0.34) FNTAPGGT1BFNTB

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 8 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1090012-A4 INHIBITORS OF PRENYL-PROTEIN TRANSFERASE MERCK & CO INC (US) 2005-04-06 EP disclosed
US-20030220241-A1 Method of treating cancer DEFEO-JONES DEBORAH (US) 2003-11-27 US disclosed
US-6562823-B1 Inhibition of farnesyl-protein transferase has been shown to block the growth of Ras-transformed cells in soft agar MERCK & CO., INC. 2003-05-13 US disclosed
EP-1090012-A1 INHIBITORS OF PRENYL-PROTEIN TRANSFERASE Merck & Co., Inc. (US) 2001-04-11 EP disclosed
WO-2000059930-A1 A METHOD OF TREATING CANCER MERCK & CO., INC. (US) 2000-10-12 WO disclosed
WO-2000025789-A1 A METHOD OF TREATING ENDOMETRIOSIS MERCK & CO., INC. (US) 2000-05-11 WO disclosed
WO-2000016778-A1 A METHOD OF TREATING CANCER MERCK & CO., INC. (US) 2000-03-30 WO disclosed
WO-2000001702-A1 INHIBITORS OF PRENYL-PROTEIN TRANSFERASE MERCK & CO., INC. (US) 2000-01-13 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-20030220241-A1 Method of treating cancer ACP3, PSAT1, LCAT FNTA 4/4885PGGT1B 274/4885FNTB 19/4885

“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.