SCHEMBL7570106

SCHEMBL7570106

Cc1ccccc1-c1cc(CNCCC2CCCCC2)ccc1C#N

nearest known ligand 0.51

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 1/20 0.42
BCHE P06276 1/20 0.38
ACHE P22303 1/20 0.38
MAOB P27338 1/20 0.38
FNTA P49354 1/20 0.37
FNTB P49356 1/20 0.37
PGGT1B P53609 1/20 0.37
NOS3 P29474 2/20 0.36
NOS1 P29475 2/20 0.36
AR P10275 1/20 0.36
CD274 Q9NZQ7 1/20 0.35

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
SCHEMBL7575970 0.85 SIGMAR1 (0.40) SIGMAR1BCHEFNTAFNTBPGGT1B
SCHEMBL7568520 0.79 KDM4E (0.45) FNTAFNTBPGGT1BAR
SCHEMBL7568457 0.74 NPY5R (0.44)
SCHEMBL7572481 0.72 HTT (0.54)
SCHEMBL23023006 0.71 SIGMAR1 (0.54) SIGMAR1ACHE
SCHEMBL23004820 0.71 CXCR4 (0.54) SIGMAR1
SCHEMBL7571837 0.70 FNTA (0.46) FNTAFNTBPGGT1B
SCHEMBL7571033 0.70 AR (0.44) FNTAFNTBPGGT1BAR
SCHEMBL7576242 0.70 AR (0.44) FNTAFNTBPGGT1BAR
Hydrochloric Acid SCHEMBL7570447 0.70 FNTA (0.46) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20020019527-A1 Substituted phenyl farnesyltransferase inhibitors ABBOTT LABORATORIES 2002-02-14 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-20020019527-A1 Substituted phenyl farnesyltransferase inhibitors FNTA, FNTB, SLC10A1 SIGMAR1 2785/4885BCHE 1697/4885ACHE 3966/4885

“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.