SCHEMBL25087124

SCHEMBL25087124

C=C(C)CO[C@H](C)C(=O)OC(C)(C)C

nearest known ligand 0.33

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.33
APLNR P35414 1/20 0.33
CA1 P00915 1/20 0.32
CA2 P00918 1/20 0.32
CA7 P43166 1/20 0.32
NOS1 P29475 2/20 0.31
NOS3 P29474 1/20 0.31
NOS2 P35228 1/20 0.31

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
SCHEMBL25087195 1.00 TSHR (0.33) TSHRAPLNRCA1CA2CA7
SCHEMBL24034198 1.00 TSHR (0.33) TSHRAPLNRCA1CA2CA7
SCHEMBL26316235 0.85 APLNR (0.35) APLNRCA1CA2CA7NOS1
SCHEMBL26316257 0.85 APLNR (0.35) APLNRCA1CA2CA7NOS1
SCHEMBL2466487 0.79 TSHR (0.36) TSHR
SCHEMBL2462875 0.78 TSHR (0.33) TSHR
SCHEMBL25086852 0.77 ALDH1A1 (0.39) TSHR
SCHEMBL25087196 0.77 ALDH1A1 (0.39) TSHR
SCHEMBL30068345 0.76 CA1 (0.35) APLNRCA1CA2CA7NOS1
SCHEMBL2463280 0.76 TSHR (0.39) TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4149941-B1 CERTAIN CHEMICAL COMPOSITIONS AND METHODS OF USE THEREOF ALGEN BIOTECHNOLOGIES INC (US) 2025-09-03 EP disclosed
US-12264152-B2 Certain chemical compositions and methods of use thereof ALGEN BIOTECHNOLOGIES, INC. (US) 2025-04-01 US disclosed
US-20230295135-A1 CERTAIN CHEMICAL COMPOSITIONS AND METHODS OF USE THEREOF ALGEN BIOTECHNOLOGIES, INC. 2023-09-21 US disclosed
US-20230295135-A1 CERTAIN CHEMICAL COMPOSITIONS AND METHODS OF USE THEREOF ALGEN BIOTECHNOLOGIES, INC. 2023-09-21 US disclosed
US-20230295135-A1 CERTAIN CHEMICAL COMPOSITIONS AND METHODS OF USE THEREOF ALGEN BIOTECHNOLOGIES, INC. 2023-09-21 US disclosed
US-11591322-B2 Certain chemical compositions and methods of use thereof ALGEN BIOTECHNOLOGIES, INC. (US) 2023-02-28 US disclosed
US-11591322-B2 Certain chemical compositions and methods of use thereof ALGEN BIOTECHNOLOGIES, INC. (US) 2023-02-28 US disclosed
US-20220289725-A1 CERTAIN CHEMICAL COMPOSITIONS AND METHODS OF USE THEREOF ALGEN BIOTECHNOLOGIES, INC. 2022-09-15 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 (4 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-20220289725-A1 CERTAIN CHEMICAL COMPOSITIONS AND METHODS OF USE THEREOF CDK9, CDK19, CDK6 TSHR 4152/4885APLNR 3607/4885CA1 1644/4885
US-11591322-B2 Certain chemical compositions and methods of use thereof CDK9, CDK19, CDK6 TSHR 4152/4885APLNR 3607/4885CA1 1644/4885
US-20230295135-A1 CERTAIN CHEMICAL COMPOSITIONS AND METHODS OF USE THEREOF CDK9, CDK19, CDK6 TSHR 4152/4885APLNR 3607/4885CA1 1644/4885
US-12264152-B2 Certain chemical compositions and methods of use thereof CDK9, CDK19, CDK6 TSHR 4152/4885APLNR 3607/4885CA1 1644/4885

“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.