SCHEMBL21294313

SCHEMBL21294313

COCC(=O)Oc1c(Cl)cc(Cl)cc1S(=O)(=O)O

nearest known ligand 0.41

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ACLY P53396 10/20 0.41
CYP1A2 P05177 1/20 0.37
CYP2C9 P11712 1/20 0.37
HIF1A Q16665 1/20 0.37
CA1 P00915 2/20 0.36
CA2 P00918 2/20 0.36
CA9 Q16790 1/20 0.36
CASR P41180 1/20 0.36
F2 P00734 1/20 0.35
PRSS1 P07477 1/20 0.35
PRSS2 P07478 1/20 0.35
PRSS3 P35030 1/20 0.35
LMNA P02545 1/20 0.35
PTPN11 Q06124 1/20 0.33

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
SCHEMBL21309558 0.78 ACLY (0.48) ACLYCA1CA2CA9F2
SCHEMBL11323103 0.75 ACLY (0.42) ACLYCA1CA2CA9
SCHEMBL21309701 0.74 ACLY (0.40) ACLY
Hydrochloric Acid SCHEMBL11323108 0.74 ACLY (0.52) ACLYHIF1A
SCHEMBL21309392 0.73 ACLY (0.35) ACLYCA1CA2
SCHEMBL21294319 0.71 ACLY (0.34) ACLYCA1CA2
SCHEMBL21309559 0.71 CXCR5 (0.50) ACLYCA1CA2CA9CASR
SCHEMBL10981786 0.70 CYP1A2 (0.45) CYP1A2CYP2C9HIF1ACA1CA2
SCHEMBL24401752 0.69 LMNA (0.46) ACLYCA1CA2CA9LMNA
SCHEMBL11513312 0.69 CA1 (0.39) ACLYCA1CA2CA9F2

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
US-11787837-B2 DCHBS-active esters of PEG compounds and their use NOVO NORDISK A/S (DK) 2023-10-17 US disclosed
US-11787837-B2 DCHBS-active esters of PEG compounds and their use NOVO NORDISK A/S (DK) 2023-10-17 US disclosed
US-11787837-B2 DCHBS-active esters of PEG compounds and their use NOVO NORDISK A/S (DK) 2023-10-17 US disclosed
CN-109922835-B DCHBS active ester of PEG compound and application thereof 诺和诺德股份有限公司 2023-08-04 CN disclosed
EP-3534962-B1 DCHBS-ACTIVE ESTERS OF PEG COMPOUNDS AND THEIR USE NOVO NORDISK AS (DK) 2020-08-19 EP disclosed
EP-3534962-A1 DCHBS-ACTIVE ESTERS OF PEG COMPOUNDS AND THEIR USE Novo Nordisk A/S (DK) 2019-09-11 EP disclosed
US-20190263854-A1 DCHBS-ACTIVE ESTERS OF PEG COMPOUNDS AND THEIR USE NOVO NORDISK A/S (DK) 2019-08-29 US disclosed
US-20190263854-A1 DCHBS-ACTIVE ESTERS OF PEG COMPOUNDS AND THEIR USE NOVO NORDISK A/S (DK) 2019-08-29 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 (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-20190263854-A1 DCHBS-ACTIVE ESTERS OF PEG COMPOUNDS AND THEIR USE HBB, IAPP, GLP1R ACLY 181/4885CYP1A2 4727/4885CYP2C9 3987/4885
US-11787837-B2 DCHBS-active esters of PEG compounds and their use HBB, IAPP, GLP1R ACLY 181/4885CYP1A2 4727/4885CYP2C9 3987/4885

“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.