SCHEMBL4523964

SCHEMBL4523964

CCOC(=O)C1CCC(O)C(N)C1

nearest known ligand 0.42

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.41
ALDH1A1 P00352 4/20 0.40
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
CYP3A4 P08684 1/20 0.39
CYP2D6 P10635 1/20 0.39
CYP2C9 P11712 1/20 0.39
CYP2C19 P33261 1/20 0.39
HSD11B1 P28845 1/20 0.37
GAA P10253 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.36

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
SCHEMBL21909908 1.00 MAPT (0.41) MAPTALDH1A1MEN1KMT2ACYP3A4
SCHEMBL16674654 1.00 MAPT (0.41) MAPTALDH1A1MEN1KMT2ACYP3A4
SCHEMBL19018901 1.00 MAPT (0.41) MAPTALDH1A1MEN1KMT2ACYP3A4
Cadaverine Tartrate SCHEMBL28688232 0.90 MAPT (0.35) MAPTALDH1A1MEN1KMT2ACYP3A4
SCHEMBL29592138 0.86 MAPT (0.41) MAPTALDH1A1MEN1KMT2ACYP3A4
SCHEMBL19018903 0.86 MAPT (0.44) MAPTALDH1A1MEN1KMT2ACYP3A4
SCHEMBL16683542 0.86 MAPT (0.44) MAPTALDH1A1MEN1KMT2ACYP3A4
SCHEMBL16674652 0.83 MAPT (0.41) MAPTALDH1A1MEN1KMT2ACYP3A4
SCHEMBL30278792 0.81 MEN1 (0.45) MAPTALDH1A1MEN1KMT2ACYP3A4
SCHEMBL1169394 0.81 MAPT (0.52) MAPTALDH1A1MEN1KMT2ACYP3A4

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
CN-115583900-A Preparation method of high-purity ixaban intermediate 张邦成都生物医药科技有限公司 2023-01-10 CN disclosed
EP-3395814-B1 INHIBITORS OF THE FIBROBLAST GROWTH FACTOR RECEPTOR BLUEPRINT MEDICINES CORP (US) 2022-04-06 EP disclosed
CN-110028491-B Fibroblast growth factor receptor inhibitors 缆图药品公司 2022-02-11 CN disclosed
CN-108486197-B Preparation method of high-purity edoxaban intermediate 爱斯特(成都)生物制药股份有限公司 2021-10-22 CN disclosed
CN-107721866-B Preparation method of edoxaban intermediate 爱斯特(成都)生物制药股份有限公司 2020-09-04 CN disclosed
US-20090298856-A1 2,3 Substituted fused bicyclic pyrimidin-4(3H)-ones modulating the function of the vanilliod-1receptor (VR1) BROWN REBECCA ELIZABETH 2009-12-03 US disclosed
EP-1881988-A1 2,3-SUBSTITUTED FUSED BICYCLIC PYRIMIDIN-4(3H)-ONES MODULATING THE FUNCTION OF THE VANILLOID-1 RECEPTOR (VR1) MERCK SHARP & DOHME LTD. (GB) 2008-01-30 EP disclosed
WO-2006122200-A1 2,3-SUBSTITUTED FUSED BICYCLIC PYRIMIDIN-4(3H)-ONES MODULATING THE FUNCTION OF THE VANILLOID-1 RECEPTOR (VR1) MERCK SHARP & DOHME LIMITED (GB) 2006-11-16 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-20090298856-A1 2,3 Substituted fused bicyclic pyrimidin-4(3H)-ones modulating the function of the vanilliod-1receptor (VR1) TRPV1, TRPV2, TRPV4 MAPT 3420/4885ALDH1A1 897/4885MEN1 4509/4885

“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.