SCHEMBL2174284

SCHEMBL2174284

CC(C)(C)OC(=O)CON1C(=O)c2ccccc2C1=O

nearest known ligand 0.69

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.56
CYP1A2 P05177 2/20 0.56
CYP2C9 P11712 1/20 0.56
GAA P10253 1/20 0.47
PTPRC P08575 2/20 0.42
MEN1 O00255 2/20 0.42
MAPT P10636 2/20 0.42
KMT2A Q03164 2/20 0.42
PTPN1 P18031 1/20 0.42
RECQL P46063 1/20 0.41
POLB P06746 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
KDM4E B2RXH2 1/20 0.40

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
SCHEMBL11346251 0.85 GAA (0.53) ALDH1A1CYP1A2CYP2C9GAAPTPRC
SCHEMBL6890669 0.82 GAA (0.50) ALDH1A1CYP1A2CYP2C9GAAPTPRC
SCHEMBL1562501 0.82 ALDH1A1 (0.61) ALDH1A1CYP1A2CYP2C9GAAMEN1
SCHEMBL13140916 0.82 ALDH1A1 (0.45) ALDH1A1CYP1A2CYP2C9GAAMEN1
SCHEMBL14950485 0.80 GAA (0.63) ALDH1A1CYP1A2CYP2C9GAAPTPRC
SCHEMBL16726879 0.80 RECQL (0.48) ALDH1A1CYP1A2CYP2C9GAAPTPRC
SCHEMBL16726882 0.80 GAA (0.63) ALDH1A1CYP1A2CYP2C9GAAPTPRC
SCHEMBL5419285 0.79 ALDH1A1 (0.58) ALDH1A1CYP1A2CYP2C9GAAMEN1
SCHEMBL13140937 0.79 PTPN1 (0.44) ALDH1A1CYP1A2CYP2C9MEN1MAPT
SCHEMBL8610167 0.78 ALDH1A1 (0.65) ALDH1A1CYP1A2CYP2C9GAAMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230265104-A1 NOVEL HETEROCYCLIC COMPOUNDS Prism BioLab Co., Ltd. (JP) 2023-08-24 US disclosed
US-9688663-B2 Crosslinking reagents, methods, and compositions for studying protein-protein interactions Cell Mosaic, Inc. (US) 2017-06-27 US disclosed
US-9682996-B2 Alpha helix mimetic compositions for treating cancer and other CBP/catenin-mediated diseases and conditions Prism BioLab Co., Ltd. (JP) 2017-06-20 US disclosed
US-20160264968-A1 MODIFIED iRNA AGENTS ALNYLAM PHARMACEUTICALS, INC. 2016-09-15 US disclosed
US-9394540-B2 Modified iRNA agents ALNYLAM PHARMACEUTICALS, INC. (US) 2016-07-19 US disclosed
US-20160159777-A1 CROSSLINKING REAGENTS, METHODS, AND COMPOSITIONS FOR STUDYING PROTEIN-PROTEIN INTERACTIONS CELLMOSAIC INC (US) 2016-06-09 US disclosed
US-9238657-B2 Cephalosporin having catechol group SHIONOGI & CO., LTD. (JP) 2016-01-19 US disclosed
US-20150376204-A1 ALPHA HELIX MIMETIC COMPOSITIONS FOR TREATING CANCER AND OTHER CBP/CATENIN-MEDIATED DISEASES AND CONDITIONS Prism BioLab Co., Ltd. (JP) 2015-12-31 US disclosed
US-9126981-B2 Alpha helix mimetic compositions for treating cancer and other CBP/catenin-mediated diseases and conditions Prism BioLab Co., Ltd. (JP) 2015-09-08 US disclosed
US-20140316124-A1 MODIDIFED iRNA AGENTS BANK OF AMERICA, N.A. 2014-10-23 US disclosed
US-4788185-A Cephalosporin compounds TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1988-11-29 US disclosed
EP-0203271-A2 Antibacterial compounds, their production and use Takeda Chemical Industries, Ltd. (JP) 1986-12-03 EP disclosed
WO-1986005183-A1 ANTIBACTERIAL COMPOUNDS, THEIR PRODUCTION AND USE TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1986-09-12 WO disclosed
EP-0187500-A1 Monobactams THE UPJOHN COMPANY (US) 1986-07-16 EP disclosed
EP-0160252-A2 Antibacterial compounds Takeda Chemical Industries, Ltd. (JP) 1985-11-06 EP disclosed
EP-0135194-A1 Azetidinones and their production Takeda Chemical Industries, Ltd. (JP) 1985-03-27 EP disclosed
EP-0021519-B1 OXYIMINO-SUBSTITUTED CYCLOPROPANE COMPOUNDS, PROCESS FOR THEIR MANUFACTURE, PESTICIDAL COMPOSITIONS AND THEIR USE AS AND IN THE MANUFACTURE OF PESTICIDES SHELL INTERNATIONALE RESEARCHMAATSCHAPPIJ B.V. (NL) 1984-07-18 EP disclosed
US-4281183-A INSECTICIDES, PESTICIDES SHELL OIL COMPANY (US) 1981-07-28 US disclosed
EP-0021519-A2 Oxyimino-substituted cyclopropane compounds, process for their manufacture, pesticidal compositions and their use as and in the manufacture of pesticides SHELL INTERNATIONALE RESEARCHMAATSCHAPPIJ B.V. (NL) 1981-01-07 EP disclosed
US-4237123-A INSECTICIDES, MITICIDES SHELL OIL COMPANY (US) 1980-12-02 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 (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-20230265104-A1 NOVEL HETEROCYCLIC COMPOUNDS MKI67, CCNI, KRAS ALDH1A1 345/4885CYP1A2 2080/4885CYP2C9 2058/4885
US-20160159777-A1 CROSSLINKING REAGENTS, METHODS, AND COMPOSITIONS FOR STUDYING PROTEIN-PROTEIN INTERACTIONS PBDC1, RCSD1, STUB1 ALDH1A1 2921/4885CYP1A2 4010/4885CYP2C9 2319/4885
US-20150376204-A1 ALPHA HELIX MIMETIC COMPOSITIONS FOR TREATING CANCER AND OTHER CBP/CATENIN-MEDIATED DISEASES AND CONDITIONS CREBBP, CTNNB1, CTNNA1 ALDH1A1 2753/4885CYP1A2 4661/4885CYP2C9 4869/4885

“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.