SCHEMBL13010604

SCHEMBL13010604

COC(=O)CC1(NC(=O)OC(C)(C)C)CC1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA2 P00918 2/20 0.41
CA12 O43570 2/20 0.41
CA14 Q9ULX7 2/20 0.41
PPIA P62937 1/20 0.36
CNR2 P34972 1/20 0.36
MEN1 O00255 2/20 0.36
KMT2A Q03164 2/20 0.36
MAPK1 P28482 1/20 0.36
CTSL P07711 1/20 0.35
APLNR P35414 1/20 0.35
P2RX7 Q99572 1/20 0.34
TDP1 Q9NUW8 1/20 0.34
CA1 P00915 2/20 0.33
CA7 P43166 2/20 0.33
DGAT1 O75907 1/20 0.33
LATS1 O95835 1/20 0.33
CYP2D6 P10635 1/20 0.33
CTSK P43235 1/20 0.33
GAA P10253 1/20 0.33
TP53 P04637 1/20 0.33

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
SCHEMBL8282998 0.92 CA12 (0.42) CA2CA12CA14PPIACNR2
SCHEMBL3022379 0.89 CA12 (0.37) CA2CA12CA14PPIACNR2
SCHEMBL25568153 0.88 CNR2 (0.37) CA2CA12CA14PPIACNR2
SCHEMBL15297512 0.84 MEN1 (0.37) CA2CA12CA14PPIAMEN1
SCHEMBL25736798 0.82 HDAC4 (0.33) CA2CA12CA14PPIAMEN1
SCHEMBL28142804 0.81 CA12 (0.37) CA2CA12CA14PPIACNR2
SCHEMBL23538650 0.81 P2RX7 (0.34) CA2CA12CA14PPIAMEN1
SCHEMBL89757 0.81 PPIA (0.37) CA2CA12CA14PPIAMEN1
SCHEMBL24457724 0.81 MEN1 (0.36) CA2CA12CA14PPIAMEN1
SCHEMBL28143617 0.80 P2RX7 (0.35) CA2CA12CA14PPIACNR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4330236-A1 COMPOUNDS, COMPOSITIONS, AND METHODS Denali Therapeutics Inc. (US) 2024-03-06 EP disclosed
CN-116507608-A Compounds, compositions, and methods 戴纳立制药公司 2023-07-28 CN disclosed
WO-2022232632-A1 COMPOUNDS, COMPOSITIONS, AND METHODS DENALI THERAPEUTICS INC. (US) 2022-11-03 WO disclosed
WO-2022109268-A1 COMPOUNDS, COMPOSITIONS, AND METHODS DENALI THERAPEUTICS INC. (US) 2022-05-27 WO disclosed
US-20210046057-A1 Beta-lactamase inhibitor and use thereof Suzhou Sinovent Pharmaceuticals Co., Ltd. (CN) 2021-02-18 US disclosed
US-20100317698-A1 Polysubstituted Pyridinylaminoalkylene- and Pyridinyloxyalkylene-Cyclopropanamine Compounds, a Process for Their Preparation and Pharmaceutical Compositions Containing Them LES LABORATOIRES SERVIER (FR) 2010-12-16 US disclosed
US-7449493-B2 Diamines as modulators of chemokine receptor activity BRISTOL-MYERS SQUIBB PHARMACEUTICAL COMPANY (US) 2008-11-11 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 (2 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-20100317698-A1 Polysubstituted Pyridinylaminoalkylene- and Pyridinyloxyalkylene-Cyclopropanamine Compounds, a Process for Their Preparation and Pharmaceutical Compositions Containing Them CHRNA6, CHRNE, CHRNG CA2 2248/4885CA12 3079/4885CA14 3066/4885
US-20210046057-A1 Beta-lactamase inhibitor and use thereof CYP51A1, LCT, CEL CA2 1322/4885CA12 1450/4885CA14 1259/4885

“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.