SCHEMBL4363280

SCHEMBL4363280

CC(C)(C)OC(=O)N1C2CCC(CC2)C1CO

nearest known ligand 0.55

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PREP P48147 4/20 0.55
CHRM2 P08172 1/20 0.54
CHRM1 P11229 1/20 0.54
CHRM3 P20309 1/20 0.54
NR1H2 P55055 1/20 0.46
HSD11B1 P28845 1/20 0.45
ELANE P08246 1/20 0.37
HPGD P15428 1/20 0.36
ABCB1 P08183 1/20 0.35
GPR119 Q8TDV5 1/20 0.35
USP2 O75604 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
CTSK P43235 1/20 0.34
RECQL P46063 1/20 0.34
EPHX1 P07099 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
SCHEMBL15934759 1.00 PREP (0.55) PREPCHRM2CHRM1CHRM3NR1H2
SCHEMBL4363279 1.00 PREP (0.55) PREPCHRM2CHRM1CHRM3NR1H2
SCHEMBL15934751 1.00 PREP (0.55) PREPCHRM2CHRM1CHRM3NR1H2
SCHEMBL981972 0.90 CHRM2 (0.59) PREPCHRM2CHRM1CHRM3NR1H2
SCHEMBL17577869 0.90 CHRM2 (0.59) PREPCHRM2CHRM1CHRM3NR1H2
SCHEMBL11912368 0.90 CHRM2 (0.59) PREPCHRM2CHRM1CHRM3NR1H2
SCHEMBL15934591 0.90 CHRM2 (0.59) PREPCHRM2CHRM1CHRM3NR1H2
SCHEMBL15773320 0.90 CHRM2 (0.59) PREPCHRM2CHRM1CHRM3NR1H2
SCHEMBL15934635 0.90 CHRM2 (0.59) PREPCHRM2CHRM1CHRM3NR1H2
SCHEMBL15934750 0.87 PREP (0.52) PREPCHRM2CHRM1CHRM3NR1H2

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
CN-115403584-B 2-thio-2, 3-dihydropyrimidine-4-one derivatives, pharmaceutical compositions, preparation methods and applications thereof 长春金赛药业有限责任公司 2024-04-02 CN disclosed
CN-115403584-A 2-thio-2, 3-dihydropyrimidine-4-one derivative, pharmaceutical composition, preparation method and application thereof 长春金赛药业有限责任公司 2022-11-29 CN disclosed
US-7618978-B2 Amides as BACE inhibitors ELI LILLY AND COMPANY (US) 2009-11-17 US disclosed
US-20070225372-A1 Amides as Bace Inhibitors ELI LILLY AND COMPANY 2007-09-27 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-20070225372-A1 Amides as Bace Inhibitors BACE2, BACE1, APP PREP 71/4885CHRM2 3688/4885CHRM1 3584/4885

“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.