SCHEMBL31369324

SCHEMBL31369324

COC[C@H](O[Si](C)(C)C(C)(C)C)c1ccc(Br)cn1

nearest known ligand 0.33

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
APLNR P35414 2/20 0.33
PREP P48147 1/20 0.32
KDM4E B2RXH2 1/20 0.31
ALDH1A1 P00352 1/20 0.31
GBA1 P04062 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
SCHEMBL30853171 1.00 APLNR (0.33) APLNRPREPKDM4EALDH1A1GBA1
SCHEMBL30262447 0.89 APLNR (0.34) APLNR
SCHEMBL26814295 0.89 APLNR (0.34) APLNR
SCHEMBL29183118 0.84 APLNR (0.36) APLNRGBA1
SCHEMBL30931230 0.84 APLNR (0.36) APLNRGBA1
SCHEMBL24747503 0.83 KDM4E (0.32) KDM4E
SCHEMBL30262452 0.83 KDM4E (0.32) KDM4E
SCHEMBL13316650 0.79 GBA1 (0.31) GBA1
SCHEMBL30262450 0.78 CYP2C19 (0.43) ALDH1A1
SCHEMBL29182971 0.78 CYP2C19 (0.43) ALDH1A1

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-20240400544-A1 N-(HYDROXYALKYL (HETERO)ARYL) TETRAHYDROFURAN CARBOXAMIDE ANALOGS AS MODULATORS OF SODIUM CHANNELS VERTEX PHARMACEUTICALS INCORPORATED (US) 2024-12-05 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-20240400544-A1 N-(HYDROXYALKYL (HETERO)ARYL) TETRAHYDROFURAN CARBOXAMIDE ANALOGS AS MODULATORS OF SODIUM CHANNELS TRPV1, SCN1A, SCN2A APLNR 1833/4885PREP 3189/4885KDM4E 3278/4885

“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.