SCHEMBL17870286

SCHEMBL17870286

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nearest known ligand 0.41

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CTSS P25774 2/20 0.41
CTSK P43235 1/20 0.41
HTT P42858 1/20 0.40
ALDH1A1 P00352 1/20 0.38
ANPEP P15144 1/20 0.37
MME P08473 2/20 0.37
ACE P12821 2/20 0.37
CPA1 P15085 2/20 0.37
ACE2 Q9BYF1 2/20 0.37
CTSL P07711 2/20 0.36
CTSB P07858 2/20 0.36
KDM4E B2RXH2 1/20 0.34
CA2 P00918 1/20 0.34
USP2 O75604 1/20 0.34
TSHR P16473 1/20 0.34
L3MBTL1 Q9Y468 2/20 0.34
MEN1 O00255 2/20 0.34
KMT2A Q03164 2/20 0.34
SMN1; SMN2 Q16637 1/20 0.34

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
SCHEMBL17870458 0.86 CTSS (0.37) CTSSCTSKCA2KMT2ASMN1; SMN2
SCHEMBL17870460 0.86 CTSS (0.37) CTSSCTSKCA2KMT2ASMN1; SMN2
SCHEMBL17884325 0.81 CTSS (0.63) CTSSCTSKHTTALDH1A1KDM4E
SCHEMBL25328927 0.81 CTSS (0.44) CTSSCTSKHTTALDH1A1ANPEP
SCHEMBL17870511 0.79 CYP2D6 (0.32) ALDH1A1MMEACECPA1ACE2
SCHEMBL17870512 0.79 CYP2D6 (0.32) ALDH1A1MMEACECPA1ACE2
SCHEMBL16284115 0.79 CTSS (0.48) CTSSCTSKHTTALDH1A1ANPEP
SCHEMBL17870150 0.77 CTSS (0.35) CTSSCTSK
SCHEMBL25198620 0.77 EPHX1 (0.50) L3MBTL1SMN1; SMN2
SCHEMBL25265258 0.77 EPHX1 (0.50) L3MBTL1SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20180265547-A1 Z-SELECTIVE OLEFIN METATHESIS OF PEPTIDES CALIFORNIA INSTITUTE OF TECHNOLOGY (US) 2018-09-20 US disclosed
US-20160185821-A1 Z-SELECTIVE OLEFIN METATHESIS OF PEPTIDES CALIFORNIA INSTITUTE OF TECHNOLOGY 2016-06-30 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 (2 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-20160185821-A1 Z-SELECTIVE OLEFIN METATHESIS OF PEPTIDES QPCT, PTMS, MAX CTSS 203/4885CTSK 194/4885HTT 1373/4885
US-20180265547-A1 Z-SELECTIVE OLEFIN METATHESIS OF PEPTIDES QPCT, PTMS, MAX CTSS 203/4885CTSK 194/4885HTT 1373/4885

“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.