SCHEMBL19852397

SCHEMBL19852397

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

nearest known ligand 0.46

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
SLC15A1 P46059 2/20 0.46
ALDH1A1 P00352 2/20 0.45
MAPK1 P28482 1/20 0.45
L3MBTL1 Q9Y468 1/20 0.45
CTSK P43235 5/20 0.43
CTSB P07858 2/20 0.43
GAA P10253 1/20 0.42
TAAR1 Q96RJ0 1/20 0.42
MMP9 P14780 1/20 0.41
CTSS P25774 2/20 0.41
CTSL P07711 1/20 0.41
ABCB1 P08183 1/20 0.41
MMP1 P03956 2/20 0.40
S1PR4 O95977 1/20 0.40
S1PR1 P21453 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
SCHEMBL18417659 0.83 ALDH1A1 (0.56) ALDH1A1MAPK1L3MBTL1CTSKCTSB
SCHEMBL16984518 0.83 ALDH1A1 (0.56) ALDH1A1MAPK1L3MBTL1CTSKCTSB
SCHEMBL12764091 0.83 ALDH1A1 (0.56) ALDH1A1MAPK1L3MBTL1CTSKCTSB
SCHEMBL23279543 0.82 ALDH1A1 (0.49) ALDH1A1MAPK1L3MBTL1CTSKCTSB
SCHEMBL7705289 0.82 ALDH1A1 (0.54) SLC15A1ALDH1A1MAPK1L3MBTL1MMP9
SCHEMBL27556474 0.79 SLC15A1 (0.58) SLC15A1ALDH1A1MAPK1L3MBTL1CTSK
SCHEMBL27556472 0.79 SLC15A1 (0.58) SLC15A1ALDH1A1MAPK1L3MBTL1CTSK
SCHEMBL18914889 0.79 ALDH1A1 (0.50) SLC15A1ALDH1A1MAPK1L3MBTL1CTSK
SCHEMBL19852396 0.79 SLC15A1 (0.44) SLC15A1ALDH1A1MAPK1L3MBTL1GAA
SCHEMBL9636201 0.78 ALDH1A1 (0.58) SLC15A1ALDH1A1MAPK1L3MBTL1MMP9

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 3 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
WO-2018027227-A1 THERMOCLEAVABLE FRICTION MODIFIERS AND METHODS THEREOF RUTGERS, THE STATE UNIVERSITY OF NEW JERSEY (US) 2018-02-08 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 (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 SLC15A1 4229/4885ALDH1A1 3303/4885MAPK1 1749/4885
US-10640725-B2 Thermocleavable friction modifiers and methods thereof F12, F5, F3 SLC15A1 4229/4885ALDH1A1 3303/4885MAPK1 1749/4885

“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.