SCHEMBL14455148

SCHEMBL14455148

CSCCC(NC(=O)OC(C)(C)C)C(=O)OCC[Si](C)(C)C

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CTSS P25774 2/20 0.57
▸ CTSK P43235 2/20 0.57
▸ EPHX2 P34913 1/20 0.48
▸ KLK7 P49862 1/20 0.46
▸ CA2 P00918 1/20 0.45
▸ HSD17B10 Q99714 2/20 0.43
▸ TSHR P16473 2/20 0.42
▸ ALDH1A1 P00352 5/20 0.42
▸ CYP1A2 P05177 1/20 0.41
▸ CYP2C9 P11712 1/20 0.41
▸ CYP2C19 P33261 1/20 0.41
▸ HTT P42858 1/20 0.41
▸ LMNA P02545 3/20 0.41
▸ MEN1 O00255 2/20 0.41
▸ KMT2A Q03164 2/20 0.41
▸ KDM4E B2RXH2 4/20 0.41
▸ MAPT P10636 2/20 0.41
▸ TLR2 O60603 1/20 0.41
▸ TLR1 Q15399 1/20 0.41
▸ THRB P10828 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
SCHEMBL18360341 0.86 CTSS (0.58) CTSSCTSKEPHX2KLK7CA2
SCHEMBL20789083 0.85 CYP1A2 (0.50) CTSSCTSKCA2ALDH1A1CYP1A2
SCHEMBL19384747 0.85 CYP1A2 (0.50) CTSSCTSKCA2ALDH1A1CYP1A2
SCHEMBL27483577 0.83 CTSK (0.64) CTSSCTSKEPHX2KLK7CA2
SCHEMBL27704332 0.83 CTSK (0.64) CTSSCTSKEPHX2KLK7CA2
SCHEMBL27688713 0.83 CTSK (0.64) CTSSCTSKEPHX2KLK7CA2
SCHEMBL13143969 0.82 CTSK (0.60) CTSSCTSKEPHX2KLK7CA2
SCHEMBL294929 0.82 CTSS (0.63) CTSSCTSKEPHX2KLK7CA2
SCHEMBL14301283 0.82 CTSS (0.63) CTSSCTSKEPHX2KLK7CA2
SCHEMBL478758 0.82 CTSS (0.63) CTSSCTSKEPHX2KLK7CA2

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-20070160526-A1 Detection, monitoring and treatment of cancer THE OPEN UNIVERSITY (GB) 2007-07-12 — — 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-20070160526-A1 Detection, monitoring and treatment of cancer MUC1, CA14, LGALS4 CTSS 4038/4885CTSK 3135/4885EPHX2 4732/4885

“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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