SCHEMBL5551508

SCHEMBL5551508

CCCC[C@H]1C(=O)N(c2cccc(C)c2C)CCN1C(Cc1ccc(C#N)cc1)c1cnc(C)[nH]1

nearest known ligand 0.44

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
FNTA P49354 8/20 0.44
FNTB P49356 8/20 0.44
PGGT1B P53609 2/20 0.43
KCNH2 Q12809 1/20 0.31
PARP14 Q460N5 1/20 0.30
GRM2 Q14416 1/20 0.30

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
SCHEMBL2381616 0.89 FNTA (0.47) FNTAFNTBPGGT1BKCNH2GRM2
SCHEMBL3501112 0.84 FNTA (0.56) FNTAFNTBPGGT1BGRM2
Trifluoroacetic Acid SCHEMBL8162228 0.84 FNTA (0.43) FNTAFNTBPGGT1BKCNH2
Hydrochloric Acid SCHEMBL8539293 0.84 FNTA (0.56) FNTAFNTBPGGT1BGRM2
SCHEMBL4405093 0.83 FNTA (0.40) FNTAFNTBPGGT1BKCNH2GRM2
SCHEMBL3687066 0.75 FNTA (0.59) FNTAFNTBPGGT1BKCNH2GRM2
SCHEMBL445626 0.75 FNTA (0.59) FNTAFNTBPGGT1BKCNH2GRM2
SCHEMBL3517007 0.73 FNTA (0.50) FNTAFNTBPGGT1BKCNH2
Hydrochloric Acid SCHEMBL7818562 0.72 FNTA (0.54) FNTAFNTBPGGT1BKCNH2GRM2
SCHEMBL5583314 0.72 FNTA (0.72) FNTAFNTBPGGT1BKCNH2

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
EP-1744751-A2 METHODS FOR THE TREATMENT OF SYNUCLEINOPATHIES THE BRIGHAM AND WOMEN'S HOSPITAL, INC. (US) 2007-01-24 EP claimed
WO-2005089502-A2 METHODS FOR THE TREATMENT OF SYNUCLEINOPATHIES THE BRIGHAM AND WOMEN'S HOSPITAL, INC. (US) 2005-09-29 WO claimed
US-20110294794-A1 TREATMENT OF PROTEINOPATHIES USING A FARNESYL TRANSFERASE INHIBITOR LINK MEDICINE CORPORATION (US) 2011-12-01 US 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-20110294794-A1 TREATMENT OF PROTEINOPATHIES USING A FARNESYL TRANSFERASE INHIBITOR FNTA, FNTB, BDNF FNTA 1/4885FNTB 2/4885PGGT1B 2649/4885

“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.