SCHEMBL6684772

SCHEMBL6684772

CC(C)(C)OC(=O)NC(CC(=O)O)CC(=O)O

nearest known ligand 0.49

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CA1 P00915 1/20 0.49
CA2 P00918 1/20 0.49
CA7 P43166 1/20 0.49
CYP2D6 P10635 1/20 0.47
ATM Q13315 1/20 0.47
CTSK P43235 14/20 0.45
CTSS P25774 9/20 0.45
MEN1 O00255 1/20 0.43
GAA P10253 1/20 0.43
KMT2A Q03164 1/20 0.43
CTSL P07711 1/20 0.43
CTSB P07858 1/20 0.43
SYK P43405 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
SCHEMBL18427981 0.93 CYP2D6 (0.54) CA1CA2CA7CYP2D6ATM
SCHEMBL17603553 0.93 CYP2D6 (0.54) CA1CA2CA7CYP2D6ATM
SCHEMBL11126904 0.91 CYP2D6 (0.45) CA1CA2CA7CYP2D6ATM
SCHEMBL5199493 0.91 APP (0.43) CA1CA2CA7CYP2D6ATM
SCHEMBL11126899 0.91 CYP2D6 (0.45) CA1CA2CA7CYP2D6ATM
SCHEMBL6829649 0.91 APP (0.43) CA1CA2CA7CYP2D6ATM
SCHEMBL344846 0.91 CA1 (0.45) CA1CA2CA7CYP2D6ATM
SCHEMBL2385476 0.91 CTSK (0.49) CA1CA2CA7CYP2D6ATM
SCHEMBL4981261 0.91 CTSK (0.49) CA1CA2CA7CYP2D6ATM
SCHEMBL3682058 0.91 CA1 (0.45) CA1CA2CA7CYP2D6ATM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2026090138-A1 ETHER-CONTAINING RADIOPAQUE POLYAMINO CROSSLINKERS AND MEDICAL HYDROGELS FORMED THEREFROM BOSTON SCIENTIFIC SCIMED, INC. (US) 2026-04-30 WO disclosed
US-20260108635-A1 ETHER-CONTAINING RADIOPAQUE POLYAMINO CROSSLINKERS AND MEDICAL HYDROGELS FORMED THEREFROM BOSTON SCIENTIFIC SCIMED, INC. (US) 2026-04-23 US disclosed
EP-3331851-A1 BETA-SUBSTITUTED BETA-AMINO ACIDS AND ANALOGS AS CHEMOTHERAPEUTIC AGENTS AND USES THEREOF Quadriga Biosciences, Inc. (US) 2018-06-13 EP disclosed
WO-2017024009-A1 BETA-SUBSTITUTED BETA-AMINO ACIDS AND ANALOGS AS CHEMOTHERAPEUTIC AGENTS AND USES THEREOF QUADRIGA BIOSCIENCES, INC. (US) 2017-02-09 WO disclosed
WO-2004089362-A1 2-CYANOPYRROLES AND THEIR ANALOGUES AS DDP-IV INHIBITORS NOVO NORDISK A/S (DK) 2004-10-21 WO disclosed
US-4415657-A USING MICRORGANISMS FOR THE STEREOSPECIFIC HYDROGENOLYSIS OF THE DIALKYL B-PROTECTED AMINO ESTER KANEGAFUCHI CHEMICAL INDUSTRY COMPANY, LIMITED (JP) 1983-11-15 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 (1 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-20260108635-A1 ETHER-CONTAINING RADIOPAQUE POLYAMINO CROSSLINKERS AND MEDICAL HYDROGELS FORMED THEREFROM BRDT, ILK, KLK3 CA1 2184/4885CA2 3056/4885CA7 1056/4885

“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.