SCHEMBL23260554

SCHEMBL23260554

CC(C)C(NC(=O)OC(C)(C)C)C(=O)OC(C)(C)C

nearest known ligand 0.58

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CTSK P43235 4/20 0.57
CTSS P25774 2/20 0.57
CA2 P00918 2/20 0.53
CA1 P00915 1/20 0.53
CA7 P43166 1/20 0.53
PREP P48147 1/20 0.49
TRPA1 O75762 2/20 0.48
CTSL P07711 2/20 0.48
CTSB P07858 1/20 0.48
CYP2D6 P10635 1/20 0.47
PSENEN Q9NZ42 1/20 0.43
KLK5 Q9Y337 1/20 0.43
CA12 O43570 1/20 0.41
CA14 Q9ULX7 1/20 0.41
ELANE P08246 1/20 0.40

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
SCHEMBL30064660 0.93 CTSK (0.59) CTSKCTSSCA2CA1CA7
SCHEMBL247552 0.90 CTSK (0.55) CTSKCTSSCA2CA1CA7
SCHEMBL9727285 0.90 CTSK (0.55) CTSKCTSSCA2CA1CA7
SCHEMBL8807250 0.90 CTSK (0.55) CTSKCTSSCA2CA1CA7
SCHEMBL1505521 0.90 CTSK (0.55) CTSKCTSSCA2CA1CA7
SCHEMBL536280 0.90 CTSK (0.47) CTSKCTSSCA2CA1CA7
SCHEMBL536281 0.90 CTSK (0.47) CTSKCTSSCA2CA1CA7
SCHEMBL30064700 0.88 CTSK (0.50) CTSKCTSSCA2CA1CA7
SCHEMBL30406679 0.88 CTSK (0.50) CTSKCTSSCA2CA1CA7
SCHEMBL21444852 0.87 CTSK (0.53) CTSKCTSSCA2CA1CA7

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-20230322715-A1 BROAD SPECTRUM ANTI-CANCER COMPOUNDS THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2023-10-12 US disclosed
WO-2021076617-A1 BROAD SPECTRUM ANTI-CANCER COMPOUNDS THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2021-04-22 WO 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-20230322715-A1 BROAD SPECTRUM ANTI-CANCER COMPOUNDS YTHDF1, YTHDF3, YTHDF2 CTSK 2268/4885CTSS 2446/4885CA2 4164/4885

“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.