SCHEMBL23308053

SCHEMBL23308053

CN(C)c1ccc2c(c1)OC1=CC(N(C)C)C=CC1=C2c1cc(C(=O)NCCOCCOCCOCCOCCC(=O)NCCC(=O)N2Cc3ccccc3C#Cc3ccccc32)ccc1C(=O)O

nearest known ligand 0.34

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ HSPA5 P11021 1/20 0.34
▸ HSPA9 P38646 1/20 0.34
▸ GBA1 P04062 2/20 0.33
▸ LMNA P02545 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
SCHEMBL21125051 0.77 GBA1 (0.52) GBA1
SCHEMBL23308017 0.74 GBA1 (0.34) GBA1
SCHEMBL29472214 0.72 ADORA3 (0.53) GBA1
SCHEMBL18441261 0.70 KMT2A (0.31) —
SCHEMBL17326936 0.70 GBA1 (0.47) GBA1
SCHEMBL29409194 0.69 KMT2A (0.38) —
SCHEMBL29388972 0.69 KMT2A (0.38) —
SCHEMBL21124664 0.69 GBA1 (0.52) GBA1
SCHEMBL22621294 0.69 NAMPT (0.34) —
SCHEMBL23025256 0.69 KDM4E (0.39) LMNA

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-20210123922-A1 APPLICATION OF CLICK CHEMISTRY FOR SIGNAL AMPLIFICATION IN IHC AND ISH ASSAYS VENTANA MED SYST INC (US) 2021-04-29 — — 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-20210123922-A1 APPLICATION OF CLICK CHEMISTRY FOR SIGNAL AMPLIFICATION IN IHC AND ISH ASSAYS MKI67, TIE1, ALK HSPA5 4577/4885HSPA9 4341/4885GBA1 4279/4885

“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.

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