SCHEMBL21804792

SCHEMBL21804792

CCOP(=O)(CC(CCCO)C(=O)OC(C)(C)C)OCC

nearest known ligand 0.40

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PPARD Q03181 2/20 0.40
CYP4F2 P78329 3/20 0.33
CYP4A11 Q02928 3/20 0.33
TDP1 Q9NUW8 1/20 0.33
MAPT P10636 1/20 0.33
MAPK1 P28482 1/20 0.33
TSHR P16473 1/20 0.32
MEN1 O00255 1/20 0.32
GAA P10253 1/20 0.32
KMT2A Q03164 1/20 0.32

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
SCHEMBL21804872 0.81 PPARD (0.44) PPARDTDP1MAPTMAPK1TSHR
SCHEMBL21805185 0.79 DGKA (0.46)
SCHEMBL23923374 0.79 HTR2C (0.39)
SCHEMBL19220632 0.77 SMN1; SMN2 (0.39) TDP1TSHR
SCHEMBL21805170 0.77 CASP2 (0.43) MAPTMEN1KMT2A
SCHEMBL23923270 0.77 CASP2 (0.43) MAPTMEN1KMT2A
SCHEMBL12410134 0.76 TSHR (0.38) PPARDMAPTMAPK1TSHRMEN1
SCHEMBL21919804 0.76 L3MBTL1 (0.45) MAPTMAPK1
SCHEMBL28086861 0.76 TDP1 (0.42) CYP4F2CYP4A11TDP1MEN1GAA
SCHEMBL28086859 0.76 TDP1 (0.42) CYP4F2CYP4A11TDP1MEN1GAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113166087-B Screening agent and use thereof 恩多塞特公司 2024-05-10 CN disclosed
US-20210323985-A1 SHIELDING AGENTS AND THEIR USE ENDOCYTE INC (US) 2021-10-21 US disclosed
EP-3853213-A1 SHIELDING AGENTS AND THEIR USE Endocyte, Inc. (US) 2021-07-28 EP disclosed
CN-113166087-A Shielding agent and application thereof 恩多塞特公司 2021-07-23 CN disclosed
WO-2020061293-A1 SHIELDING AGENTS AND THEIR USE ENDOCYTE, INC. (US) 2020-03-26 WO 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-20210323985-A1 SHIELDING AGENTS AND THEIR USE PSMA6, PSMA2, PSMA1 PPARD 3169/4885CYP4F2 4651/4885CYP4A11 4879/4885

“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.