SCHEMBL31461648

SCHEMBL31461648

CCCCC(NC(=O)OCC1C=C1C)C(=O)O

nearest known ligand 0.43

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CTSL P07711 3/20 0.43
CTSS P25774 3/20 0.43
TGM2 P21980 2/20 0.43
SIRT2 Q8IXJ6 1/20 0.43
SIRT1 Q96EB6 1/20 0.43
CA2 P00918 1/20 0.41
CTSK P43235 6/20 0.41
MME P08473 2/20 0.40
ECE1 P42892 1/20 0.40
NOD1 Q9Y239 3/20 0.40
TLR2 O60603 2/20 0.39
CTSB P07858 1/20 0.39
CTSH P09668 1/20 0.39
FOLH1 Q04609 1/20 0.39
MDM2 Q00987 1/20 0.39

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
SCHEMBL19689233 0.87 FOLH1 (0.45) TGM2CA2ECE1FOLH1
SCHEMBL9832048 0.81 NOD1 (0.49) CTSLCTSSTGM2SIRT2SIRT1
SCHEMBL9832042 0.81 NOD1 (0.49) CTSLCTSSTGM2SIRT2SIRT1
SCHEMBL9830451 0.76 NOD1 (0.47) CTSLCTSSTGM2SIRT2SIRT1
SCHEMBL9830456 0.76 NOD1 (0.47) CTSLCTSSTGM2SIRT2SIRT1
SCHEMBL1077922 0.76 NOD1 (0.48) CTSLCTSSTGM2SIRT2SIRT1
SCHEMBL6269749 0.76 NOD1 (0.51) TGM2SIRT2SIRT1NOD1FOLH1
SCHEMBL7382637 0.76 NOD1 (0.48) CTSLCTSSTGM2SIRT2SIRT1
SCHEMBL1000115 0.76 TLR2 (0.62) TLR2MDM2
SCHEMBL1044856 0.76 TLR2 (0.62) TLR2MDM2

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-20250115626-A1 BIFUNCTIONAL LINKER COMPRISING METAALLYLSILANE AND METHOD FOR PREPARING SAME INDUSTRY-UNIVERSITY COOPERATION FOUNDATION HANYANG UNIVERSITY ERICA CAMPUS (KR) 2025-04-10 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-20250115626-A1 BIFUNCTIONAL LINKER COMPRISING METAALLYLSILANE AND METHOD FOR PREPARING SAME MSN, MTCL3, TLN1 CTSL 478/4885CTSS 1426/4885TGM2 3790/4885

“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.