SCHEMBL23202782

SCHEMBL23202782

CC=CC(=O)OC(CCCCCC)CCCOC(=O)c1ccccc1C(=O)OC(=O)O

nearest known ligand 0.52

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 9/20 0.52
▸ TSHR P16473 6/20 0.52
▸ LMNA P02545 3/20 0.52
▸ CYP3A4 P08684 3/20 0.50
▸ MAPK1 P28482 3/20 0.50
▸ TP53 P04637 1/20 0.50
▸ L3MBTL1 Q9Y468 3/20 0.48
▸ TDP1 Q9NUW8 2/20 0.48
▸ KDM4E B2RXH2 3/20 0.47
▸ MAPT P10636 1/20 0.47
▸ SMN1; SMN2 Q16637 1/20 0.47
▸ PRSS1 P07477 1/20 0.46
▸ PRSS2 P07478 1/20 0.46
▸ PRSS3 P35030 1/20 0.46
▸ HSD17B10 Q99714 2/20 0.45
▸ POLB P06746 1/20 0.45
▸ CA2 P00918 1/20 0.40
▸ CNR2 P34972 1/20 0.37
▸ HCAR2 Q8TDS4 2/20 0.36

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
SCHEMBL23202735 0.96 TSHR (0.50) ALDH1A1TSHRLMNACYP3A4MAPK1
SCHEMBL23202791 0.91 TSHR (0.45) ALDH1A1TSHRLMNACYP3A4MAPK1
SCHEMBL23202779 0.80 TSHR (0.54) ALDH1A1TSHRLMNACYP3A4MAPK1
SCHEMBL27937622 0.79 ALDH1A1 (0.75) ALDH1A1TSHRLMNACYP3A4MAPK1
SCHEMBL29447720 0.78 ALDH1A1 (0.73) ALDH1A1TSHRLMNACYP3A4MAPK1
SCHEMBL29447771 0.77 ALDH1A1 (0.71) ALDH1A1TSHRLMNACYP3A4MAPK1
SCHEMBL6729570 0.75 ALDH1A1 (0.64) ALDH1A1TSHRLMNACYP3A4MAPK1
SCHEMBL6729581 0.75 ALDH1A1 (0.64) ALDH1A1TSHRLMNACYP3A4MAPK1
Maleic Acid SCHEMBL27968271 0.75 ALDH1A1 (0.82) ALDH1A1TSHRLMNACYP3A4MAPK1
SCHEMBL9697816 0.75 ALDH1A1 (0.77) ALDH1A1TSHRLMNACYP3A4MAPK1

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-11602490-B2 One pack-type dental adhesive composition SHOFU INC. (JP) 2023-03-14 — — US disclosed
US-20210205181-A1 ONE PACK-TYPE DENTAL ADHESIVE COMPOSITION SHOFU INC. (JP) 2021-07-08 — — US disclosed
EP-3804688-A1 ONE PACK-TYPE DENTAL ADHESIVE COMPOSITION Shofu Inc. (JP) 2021-04-14 — — EP 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-20210205181-A1 ONE PACK-TYPE DENTAL ADHESIVE COMPOSITION ITGA1, TAS2R1, ITGB1 ALDH1A1 330/4885TSHR 4318/4885LMNA 2210/4885
US-11602490-B2 One pack-type dental adhesive composition ITGA1, TAS2R1, ITGB1 ALDH1A1 330/4885TSHR 4318/4885LMNA 2210/4885

“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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