SCHEMBL23004339

SCHEMBL23004339

CC(C)(C)OC(=O)C1CCCC1C(=O)O

nearest known ligand 0.47

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
BTK Q06187 1/20 0.47
PEPD P12955 1/20 0.41
ACE P12821 1/20 0.38
HSD17B10 Q99714 1/20 0.35
MEN1 O00255 1/20 0.34
BLM P54132 1/20 0.34
KMT2A Q03164 1/20 0.34
MAPK1 P28482 1/20 0.34

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
SCHEMBL18590666 1.00 BTK (0.47) BTKPEPDACEHSD17B10MEN1
SCHEMBL15023147 1.00 BTK (0.47) BTKPEPDACEHSD17B10MEN1
SCHEMBL1296980 0.96 BTK (0.44) BTKPEPD
SCHEMBL20405088 0.92 BTK (0.46) BTKHSD17B10MAPK1
Ethylene Glycol SCHEMBL1296627 0.89 BTK (0.40) BTKPEPD
SCHEMBL1297246 0.89 BTK (0.45) BTKPEPDACEHSD17B10MEN1
SCHEMBL1296115 0.87 EPHX1 (0.41) BTKHSD17B10MAPK1
SCHEMBL1297250 0.86 BTK (0.42) BTKPEPDACEHSD17B10MAPK1
SCHEMBL8140944 0.84 CHRM2 (0.43) BTK
SCHEMBL8181924 0.84 CHRM2 (0.43) BTK

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023176867-A1 METHOD FOR PRODUCING 2-ACETYL-1-PYRROLINE 日清食品ホールディングス株式会社 2023-09-21 WO disclosed
CN-111777477-B Method for synthesizing succinic acid derivative or 3-aryl propionic acid 四川大学 2021-09-14 CN disclosed
US-20210053981-A1 ANTIVIRAL COMPOUNDS GILEAD SCIENCES, INC. 2021-02-25 US disclosed
CN-111777477-A Method for synthesizing succinic acid derivative or 3-aryl propionic acid 四川大学 2020-10-16 CN 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-20210053981-A1 ANTIVIRAL COMPOUNDS MAVS, EIF2AK2, SARS1 BTK 3709/4885PEPD 1017/4885ACE 133/4885

“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.