SCHEMBL24300175

SCHEMBL24300175

CCCCC(C)SC(C)C

nearest known ligand 0.38

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
DNM1 Q05193 2/20 0.38
TSHR P16473 4/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
OPRM1 P35372 1/20 0.36
ALDH1A1 P00352 3/20 0.33
TDP1 Q9NUW8 1/20 0.33
CYP3A4 P08684 1/20 0.32
FDPS P14324 1/20 0.32
LMNA P02545 1/20 0.32
CA2 P00918 2/20 0.31
MAPK1 P28482 1/20 0.31
CA1 P00915 1/20 0.30
THRB P10828 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
SCHEMBL18419736 0.92 OPRM1 (0.46) DNM1TSHROPRM1FDPSLMNA
SCHEMBL19054491 0.92 OPRM1 (0.46) DNM1TSHROPRM1FDPSLMNA
SCHEMBL23618041 0.90 OPRM1 (0.44) DNM1TSHROPRM1FDPSLMNA
SCHEMBL776356 0.88 DNM1 (0.41) DNM1TSHRSMN1; SMN2OPRM1ALDH1A1
SCHEMBL2954654 0.82
SCHEMBL10634837 0.80 OPRM1 (0.50) DNM1TSHROPRM1FDPSLMNA
SCHEMBL7967931 0.79 TSHR (0.39) DNM1TSHRSMN1; SMN2OPRM1ALDH1A1
SCHEMBL7749124 0.78 OPRM1 (0.48) DNM1TSHROPRM1FDPSLMNA
SCHEMBL7628846 0.78 OPRM1 (0.48) DNM1TSHROPRM1FDPSLMNA
SCHEMBL10631973 0.78 OPRM1 (0.48) DNM1TSHROPRM1FDPSLMNA

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-20220073538-A1 Immunoproteasome Inhibitors PRINCIPIA BIOPHARMA INC. (US) 2022-03-10 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-20220073538-A1 Immunoproteasome Inhibitors PSMC2, PSMB7, PSMB2 DNM1 2462/4885TSHR 4783/4885SMN1; SMN2 1377/4885

“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.