SCHEMBL22381458

SCHEMBL22381458

Bc1cc(F)c(F)c(OC(=O)C(C)C)c1P

nearest known ligand 0.34

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ ELANE P08246 2/20 0.33
▸ KDM4E B2RXH2 1/20 0.33
▸ ALDH1A1 P00352 1/20 0.33
▸ MAPT P10636 1/20 0.33
▸ HTT P42858 1/20 0.33
▸ ALOX15 P16050 1/20 0.32
▸ CES2 O00748 1/20 0.30
▸ CES1 P23141 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
SCHEMBL22381468 0.87 MAPT (0.37) ELANEKDM4EALDH1A1MAPTHTT
SCHEMBL12213944 0.83 MAPT (0.42) ELANEKDM4EALDH1A1MAPTHTT
SCHEMBL23057573 0.82 ELANE (0.36) ELANEKDM4EALDH1A1MAPTHTT
SCHEMBL23057564 0.77 ELANE (0.33) ELANEALOX15
SCHEMBL19105004 0.77 ELANE (0.37) ELANEKDM4EALDH1A1MAPTHTT
SCHEMBL26316856 0.75 ELANE (0.34) ELANE
SCHEMBL26144736 0.72 ELANE (0.30) ELANE
SCHEMBL11915792 0.71 ELANE (0.42) ELANEALOX15
SCHEMBL21503687 0.71 ELANE (0.48) ELANEALOX15CES2CES1
SCHEMBL17662449 0.71 ELANE (0.40) ELANEALDH1A1ALOX15CES2CES1

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-10758636-B2 Residualizing linkers and uses thereof CENTRE FOR PROBE DEVELOPMENT AND COMMERCIALIZATION (CA) 2020-09-01 — — 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-10758636-B2 Residualizing linkers and uses thereof CD44, CD47, MTCL3 ELANE 3316/4885KDM4E 937/4885ALDH1A1 619/4885

“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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