SCHEMBL19852381

SCHEMBL19852381

COC(C(=O)OCc1ccccc1)C(O)C(=O)OCc1ccccc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.53
LTA4H P09960 2/20 0.49
LAP3 P28838 1/20 0.49
KMT2A Q03164 3/20 0.47
TDP1 Q9NUW8 2/20 0.47
MAPK1 P28482 1/20 0.47
L3MBTL1 Q9Y468 1/20 0.47
SLC6A2 P23975 1/20 0.47
SLC6A3 Q01959 1/20 0.47
LMNA P02545 1/20 0.44
HCAR2 Q8TDS4 1/20 0.44
NPC1 O15118 2/20 0.43
PTGS2 P35354 1/20 0.42
ABCB1 P08183 1/20 0.42
RAB9A P51151 1/20 0.42
MAPT P10636 1/20 0.42
HPGD P15428 1/20 0.42
ELANE P08246 1/20 0.42
MEN1 O00255 1/20 0.41
CYP1A2 P05177 1/20 0.41

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
SCHEMBL19846214 0.90 ALDH1A1 (0.54) ALDH1A1LTA4HLAP3KMT2ATDP1
SCHEMBL23135770 0.85 ALDH1A1 (0.55) ALDH1A1KMT2ATDP1MAPK1L3MBTL1
SCHEMBL15114576 0.85 ALDH1A1 (0.55) ALDH1A1KMT2ATDP1MAPK1L3MBTL1
SCHEMBL22432070 0.85 ALDH1A1 (0.55) ALDH1A1KMT2ATDP1MAPK1L3MBTL1
SCHEMBL1600361 0.84 ALDH1A1 (0.61) ALDH1A1LTA4HLAP3KMT2ATDP1
SCHEMBL366832 0.84 ALDH1A1 (0.61) ALDH1A1LTA4HLAP3KMT2ATDP1
SCHEMBL14066236 0.84 ALDH1A1 (0.61) ALDH1A1LTA4HLAP3KMT2ATDP1
SCHEMBL6575848 0.84 ALDH1A1 (0.61) ALDH1A1LTA4HLAP3KMT2ATDP1
SCHEMBL12698150 0.83 ALDH1A1 (0.49) ALDH1A1LTA4HLAP3KMT2ATDP1
Ammonia Solution, Strong SCHEMBL27553566 0.81 ALDH1A1 (0.55) ALDH1A1LTA4HLAP3KMT2ATDP1

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 ALDH1A1 3303/4885LTA4H 548/4885LAP3 4790/4885
US-10640725-B2 Thermocleavable friction modifiers and methods thereof F12, F5, F3 ALDH1A1 3303/4885LTA4H 548/4885LAP3 4790/4885

“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.