SCHEMBL728692

SCHEMBL728692

CC(C)(CC(=O)O)C(=O)C(=O)O

nearest known ligand 0.52

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
HMGCR P04035 1/20 0.50
CHRM1 P11229 1/20 0.50
TBXA2R P21731 1/20 0.50
ADRA1A P35348 1/20 0.50
KDM4E B2RXH2 1/20 0.48
TSHR P16473 2/20 0.48
CYP2C19 P33261 2/20 0.48
HIF1A Q16665 2/20 0.48
CYP2D6 P10635 1/20 0.48
FFAR1 O14842 1/20 0.42
CPT2 P23786 1/20 0.42
TDP1 Q9NUW8 1/20 0.42
ALDH1A1 P00352 2/20 0.38
TET2 Q6N021 1/20 0.34
FFAR3 O14843 1/20 0.33
SLC22A6 Q4U2R8 1/20 0.32
ACLY P53396 2/20 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
SCHEMBL17687579 0.82 HMGCR (0.35) HMGCRCHRM1TBXA2RADRA1AKDM4E
Hydrochloric Acid SCHEMBL4137653 0.77 TSHR (0.60) HMGCRCHRM1TBXA2RADRA1AKDM4E
SCHEMBL83915 0.77 TSHR (0.60) HMGCRCHRM1TBXA2RADRA1AKDM4E
SCHEMBL126425 0.76 HMGCR (0.55) HMGCRCHRM1TBXA2RADRA1AKDM4E
SCHEMBL9314915 0.75 FAAH (0.35) HMGCRCHRM1TBXA2RADRA1ATSHR
SCHEMBL30703619 0.75 TSHR (0.42) HMGCRCHRM1TBXA2RADRA1AKDM4E
SCHEMBL166880 0.74 TSHR (0.40) HMGCRCHRM1TBXA2RADRA1ATSHR
SCHEMBL392087 0.74 TSHR (0.40) HMGCRCHRM1TBXA2RADRA1ATSHR
SCHEMBL8844260 0.74 TSHR (0.57) HMGCRCHRM1TBXA2RADRA1AKDM4E
Ammonia Solution, Strong SCHEMBL10868076 0.74 TSHR (0.57) HMGCRCHRM1TBXA2RADRA1AKDM4E

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 181 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3796922-B1 PHARMACEUTICAL COMPOSITIONS COMPRISING A SELENO AMINO ACID COMPOUND FOR USE IN COMBINATION WITH ANOTHER AGENT FOR THE TREATMENT OF LIVER OR PANCREAS CANCER SELEQ OY (FI) 2026-03-18 EP claimed
US-12310936-B2 Pharmaceutical compositions for the treatment of cancer SELEQ OY (FI) 2025-05-27 US claimed
US-20250136932-A1 COMPOSITIONS AND METHODS FOR CULTURING AND MAINTAINING TROPHOBLAST STEM CELLS NORTH CAROLINA STATE UNIVERSITY 2025-05-01 US claimed
WO-2023147001-A1 COMPOSITIONS AND METHODS FOR CULTURING AND MAINTAINING TROPHOBLAST STEM CELLS NORTH CAROLINA STATE UNIVERSITY (US) 2023-08-03 WO claimed
EP-3218010-B1 POLYMER COMPOSED OF REPEAT UNITS HAVING A BIOLOGICALLY ACTIVE MOLECULE ATTACHED THERETO VIA A PH-SENSITIVE BOND SPIREA LTD (GB) 2022-10-26 EP claimed
US-20210220310-A1 PHARMACEUTICAL COMPOSITIONS FOR THE TREATMENT OF CANCER SELEQ OY (FI) 2021-07-22 US claimed
US-11020408-B2 Polymer composed of repeat units having a biologically active molecule attached thereto via a pH-sensitive bond SPIREA LIMITED (GB) 2021-06-01 US claimed
EP-3796922-A1 PHARMACEUTICAL COMPOSITIONS FOR THE TREATMENT OF CANCER Seleq Oy (FI) 2021-03-31 EP claimed
WO-2020209059-A1 PHARMACEUTICAL COMPOSITION FOR TREATING HYPERAMMONEMIA 学校法人 久留米大学 2020-10-15 WO claimed
US-20200289531-A1 POLYMER COMPOSED OF REPEAT UNITS HAVING A BIOLOGICALLY ACTIVE MOLECULE ATTACHED THERETO VIA A PH-SENSITIVE BOND SPIREA LIMITED (GB) 2020-09-17 US claimed
US-10709717-B2 Polymer composed of repeat units having a biologically active molecule attached thereto via a pH-sensitive bond SPIREA LIMITED (GB) 2020-07-14 US claimed
EP-3218010-A1 POLYMER COMPOSED OF REPEAT UNITS HAVING A BIOLOGICALLY ACTIVE MOLECULE ATTACHED THERETO VIA A PH-SENSITIVE BOND Spirea Limited (GB) 2017-09-20 EP claimed
US-20170224828-A1 POLYMER COMPOSED OF REPEAT UNITS HAVING A BIOLOGICALLY ACTIVE MOLECULE ATTACHED THERETO VIA A PH-SENSITIVE BOND SPIREA LIMITED (GB) 2017-08-10 US claimed
WO-2016059391-A1 POLYMER COMPOSED OF REPEAT UNITS HAVING A BIOLOGICALLY ACTIVE MOLECULE ATTACHED THERETO VIA A PH-SENSITIVE BOND OUBERAI MYRIAM MARIE (GB) 2016-04-21 WO claimed
EP-0219923-B1 ANTIBIOTIC DERIVATIVES, THEIR PRODUCTION AND USE Takeda Chemical Industries, Ltd. (JP) 1992-09-02 EP claimed
EP-3796922-B1 PHARMACEUTICAL COMPOSITIONS COMPRISING A SELENO AMINO ACID COMPOUND FOR USE IN COMBINATION WITH ANOTHER AGENT FOR THE TREATMENT OF LIVER OR PANCREAS CANCER SELEQ OY (FI) 2026-03-18 EP disclosed
US-20250367157-A1 COMPOSITION FOR USE IN THE TREATMENT OF DISEASES ASSOCIATED WITH DYSFUNCTION OF MITOCHONDRIAE IUF LEIBNIZ INST FUER UMWELTMEDIZINISCHE FORSCHUNG GMBH (DE) 2025-12-04 US disclosed
EP-0219923-B1 ANTIBIOTIC DERIVATIVES, THEIR PRODUCTION AND USE Takeda Chemical Industries, Ltd. (JP) 1992-09-02 EP disclosed
US-4851422-A Antibiotic 2-(3-oxo-2-isoxazolidinyl)-5-oxo-2-tetrahydrofuran-carboxylates TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1989-07-25 US disclosed
EP-0219923-A1 Antibiotic derivatives, their production and use Takeda Chemical Industries, Ltd. (JP) 1987-04-29 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 (6 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-11020408-B2 Polymer composed of repeat units having a biologically active molecule attached thereto via a pH-sensitive bond IL1R1, SRRM2, H1-2 HMGCR 680/4885CHRM1 1044/4885TBXA2R 1562/4885
US-20170224828-A1 POLYMER COMPOSED OF REPEAT UNITS HAVING A BIOLOGICALLY ACTIVE MOLECULE ATTACHED THERETO VIA A PH-SENSITIVE BOND IL1R1, SRRM2, H1-2 HMGCR 680/4885CHRM1 1044/4885TBXA2R 1562/4885
US-20210220310-A1 PHARMACEUTICAL COMPOSITIONS FOR THE TREATMENT OF CANCER RNASE1, SELENOI, GLS2 HMGCR 1075/4885CHRM1 4843/4885TBXA2R 3431/4885
US-20200289531-A1 POLYMER COMPOSED OF REPEAT UNITS HAVING A BIOLOGICALLY ACTIVE MOLECULE ATTACHED THERETO VIA A PH-SENSITIVE BOND IL1R1, SRRM2, H1-2 HMGCR 680/4885CHRM1 1044/4885TBXA2R 1562/4885
US-10709717-B2 Polymer composed of repeat units having a biologically active molecule attached thereto via a pH-sensitive bond IL1R1, SRRM2, H1-2 HMGCR 680/4885CHRM1 1044/4885TBXA2R 1562/4885
US-12310936-B2 Pharmaceutical compositions for the treatment of cancer RNASE1, SELENOI, GLS2 HMGCR 1075/4885CHRM1 4843/4885TBXA2R 3431/4885

“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.