SCHEMBL22115709

SCHEMBL22115709

CN(C)OC(=O)c1ccc(C(=O)O)cc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.52
TP53 P04637 1/20 0.52
ALDH1A1 P00352 4/20 0.48
CA1 P00915 3/20 0.48
CA2 P00918 3/20 0.48
SMN1; SMN2 Q16637 1/20 0.48
SRD5A2 P31213 2/20 0.46
MAPT P10636 2/20 0.44
CA12 O43570 1/20 0.44
CA3 P07451 1/20 0.44
TYR P14679 1/20 0.44
DRD1 P21728 1/20 0.44
CA4 P22748 1/20 0.44
CA6 P23280 1/20 0.44
CA5A P35218 1/20 0.44
CA7 P43166 1/20 0.44
CA9 Q16790 1/20 0.44
CA14 Q9ULX7 1/20 0.44
CA5B Q9Y2D0 1/20 0.44
KMT2A Q03164 4/20 0.44

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
SCHEMBL4854177 0.91 CA1 (0.44) TSHRALDH1A1CA1CA2SMN1; SMN2
SCHEMBL229327 0.84 TSHR (0.58) TSHRTP53ALDH1A1SMN1; SMN2MAPT
SCHEMBL27469371 0.83 TSHR (0.56) TSHRTP53ALDH1A1SMN1; SMN2MAPT
SCHEMBL2420458 0.83 TDP1 (0.59) ALDH1A1SMN1; SMN2SRD5A2MAPTKMT2A
SCHEMBL2648403 0.83 CA12 (0.59) TSHRALDH1A1CA1CA2SMN1; SMN2
SCHEMBL15090414 0.81 CA1 (0.38) TSHRALDH1A1CA1CA2SMN1; SMN2
SCHEMBL28809439 0.80 HSD17B10 (0.48) ALDH1A1CA1CA2MAPTCA12
SCHEMBL2419117 0.79 ALDH1A1 (0.55) TSHRALDH1A1CA1CA2SMN1; SMN2
SCHEMBL6646577 0.79 TSHR (0.43) TSHRTP53ALDH1A1CA1CA2
Terephthalic Acid SCHEMBL9407876 0.78 TSHR (0.75) TSHRTP53ALDH1A1CA1CA2

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 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3669854-B1 PHOTOPOLYMERIZABLE DENTAL COMPOSITION G C DENTAL IND CORP (JP) 2026-04-08 EP disclosed
US-20250064686-A1 DENTAL CURABLE COMPOSITION CONTAINING ULTRAVIOLET ABSORBER SHOFU INC (JP) 2025-02-27 US disclosed
EP-4473954-A1 DENTAL CURABLE COMPOSITION CONTAINING ULTRAVIOLET ABSORBER Shofu Inc. (JP) 2024-12-11 EP disclosed
WO-2023191113-A1 SELF-ADHESIVE COMPOSITE RESIN FOR DENTAL USE クラレノリタケデンタル株式会社 2023-10-05 WO disclosed
US-11135137-B2 Dental photopolymerizable composition GC CORPORATION (JP) 2021-10-05 US disclosed
US-20210038481-A1 DENTAL PHOTOPOLYMERIZABLE COMPOSITION GC CORPORATION (JP) 2021-02-11 US disclosed
EP-3669854-A1 PHOTOPOLYMERIZABLE DENTAL COMPOSITION GC Corporation (JP) 2020-06-24 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 (3 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-20250064686-A1 DENTAL CURABLE COMPOSITION CONTAINING ULTRAVIOLET ABSORBER ERCC1, DSC1, CRYAA TSHR 4039/4885TP53 1987/4885ALDH1A1 479/4885
US-11135137-B2 Dental photopolymerizable composition ALAD, HTT, PPA1 TSHR 2336/4885TP53 501/4885ALDH1A1 634/4885
US-20210038481-A1 DENTAL PHOTOPOLYMERIZABLE COMPOSITION ALAD, HTT, PPA1 TSHR 2336/4885TP53 501/4885ALDH1A1 634/4885

“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.