SCHEMBL19852333

SCHEMBL19852333

CC(C)CC(C)C(=O)OC(C(=O)OCc1ccccc1)C(O)C(=O)OCc1ccccc1

nearest known ligand 0.44

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CTSK P43235 9/20 0.44
CTSS P25774 2/20 0.44
CTSB P07858 2/20 0.44
CTSL P07711 1/20 0.44
ALDH1A1 P00352 2/20 0.44
LTA4H P09960 1/20 0.42
LAP3 P28838 1/20 0.42
PSMB1 P20618 1/20 0.42

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
SCHEMBL19852382 0.86 CTSK (0.45) CTSKCTSSCTSBCTSLALDH1A1
SCHEMBL18417659 0.84 ALDH1A1 (0.56) CTSKCTSSCTSBCTSLALDH1A1
SCHEMBL16984518 0.84 ALDH1A1 (0.56) CTSKCTSSCTSBCTSLALDH1A1
SCHEMBL12764091 0.84 ALDH1A1 (0.56) CTSKCTSSCTSBCTSLALDH1A1
SCHEMBL23279543 0.83 ALDH1A1 (0.49) CTSKCTSSCTSBCTSLALDH1A1
SCHEMBL19852381 0.78 ALDH1A1 (0.53) ALDH1A1LTA4HLAP3
SCHEMBL19852397 0.77 SLC15A1 (0.46) CTSKCTSSCTSBCTSLALDH1A1
SCHEMBL5093747 0.76 ALDH1A1 (0.55) CTSKCTSSCTSBCTSLALDH1A1
SCHEMBL14124942 0.76 ALDH1A1 (0.55) CTSKCTSSCTSBCTSLALDH1A1
SCHEMBL5415396 0.76 ALDH1A1 (0.55) CTSKCTSSCTSBCTSLALDH1A1

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-10640725-B2 Thermocleavable friction modifiers and methods thereof RUTGERS, THE STATE UNIVERSITY OF NEW JERSEY (US) 2020-05-05 US disclosed
US-20180037840-A1 THERMOCLEAVABLE FRICTION MODIFIERS AND METHODS THEREOF RUTGERS, THE STATE UNIVERSITY OF NEW JERSEY (US) 2018-02-08 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-20180037840-A1 THERMOCLEAVABLE FRICTION MODIFIERS AND METHODS THEREOF F12, F5, F3 CTSK 4219/4885CTSS 4317/4885CTSB 4287/4885
US-10640725-B2 Thermocleavable friction modifiers and methods thereof F12, F5, F3 CTSK 4219/4885CTSS 4317/4885CTSB 4287/4885

“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.