SCHEMBL47703

SCHEMBL47703

CCCCCCC(=O)NCCCC[C@H](C)C(=O)O

nearest known ligand 0.59

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ CASP2 P42575 1/20 0.59
▸ FAAH O00519 7/20 0.57
▸ EPHX2 P34913 3/20 0.56
▸ ACE2 Q9BYF1 1/20 0.56
▸ NAAA Q02083 1/20 0.56
▸ DNM1 Q05193 2/20 0.54
▸ NOD1 Q9Y239 1/20 0.53
▸ SLC6A5 Q9Y345 2/20 0.51
▸ KDM4E B2RXH2 1/20 0.49
▸ MEN1 O00255 1/20 0.49
▸ MAPK1 P28482 1/20 0.49
▸ KMT2A Q03164 1/20 0.49

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
SCHEMBL12666301 1.00 CASP2 (0.59) CASP2FAAHEPHX2ACE2NAAA
SCHEMBL10088131 0.98 CASP2 (0.56) CASP2FAAHEPHX2ACE2NAAA
SCHEMBL10083874 0.92 EPHX2 (0.71) FAAHEPHX2SLC6A5KDM4EMEN1
SCHEMBL13706976 0.89 EPHX2 (0.54) CASP2FAAHEPHX2KDM4EMAPK1
SCHEMBL13706974 0.89 EPHX2 (0.54) CASP2FAAHEPHX2KDM4EMAPK1
SCHEMBL16944361 0.89 EPHX2 (0.54) CASP2FAAHEPHX2KDM4EMAPK1
SCHEMBL12891255 0.89 EPHX2 (0.54) CASP2FAAHEPHX2KDM4EMAPK1
SCHEMBL12666256 0.89 EPHX2 (0.54) CASP2FAAHEPHX2KDM4EMAPK1
SCHEMBL12891252 0.89 EPHX2 (0.54) CASP2FAAHEPHX2KDM4EMAPK1
SCHEMBL19069567 0.89 CASP2 (0.59) CASP2FAAHEPHX2ACE2NAAA

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170100490-A1 Prodrug Comprising a Drug Linker Conjugate ASCENDIS PHARMA A/S (DK) 2017-04-13 — — US disclosed
US-20150057221-A1 PRODRUG COMPRISING A DRUG LINKER CONJUGATE ASCENDIS PHARMA AS (DK) 2015-02-26 — — US disclosed
US-8906847-B2 Prodrug comprising a drug linker conjugate ASCENDIS PHARMA A/S (DK) 2014-12-09 — — US disclosed
US-20110053848-A1 PRODRUG COMPRISING A DRUG LINKER CONJUGATE ASCENDIS PHARMA AS (DK) 2011-03-03 — — 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 (3 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-20150057221-A1 PRODRUG COMPRISING A DRUG LINKER CONJUGATE H1-0, H1-3, H1-2 CASP2 2622/4885FAAH 1647/4885EPHX2 1083/4885
US-20170100490-A1 Prodrug Comprising a Drug Linker Conjugate H1-0, H1-3, H1-2 CASP2 2622/4885FAAH 1647/4885EPHX2 1083/4885
US-20110053848-A1 PRODRUG COMPRISING A DRUG LINKER CONJUGATE H1-0, H1-3, H1-2 CASP2 2622/4885FAAH 1628/4885EPHX2 1083/4885

“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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