SCHEMBL4670545

SCHEMBL4670545

CCOC(=O)N1CCC(NC(=O)OC(C)(C)C)CC1

nearest known ligand 0.56

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
THRB P10828 2/20 0.56
L3MBTL1 Q9Y468 2/20 0.56
ATM Q13315 1/20 0.56
EPHX1 P07099 1/20 0.56
KMT2A Q03164 3/20 0.53
MEN1 O00255 2/20 0.53
ALDH1A1 P00352 2/20 0.52
TSHR P16473 2/20 0.52
CYP2C9 P11712 1/20 0.52
HSD11B1 P28845 1/20 0.52
CTSK P43235 2/20 0.51
LMNA P02545 2/20 0.49
GAA P10253 1/20 0.49
POLB P06746 1/20 0.48
MAPK1 P28482 1/20 0.48
HPGD P15428 1/20 0.47

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
SCHEMBL3187254 0.95 THRB (0.51) THRBL3MBTL1ATMEPHX1KMT2A
SCHEMBL655026 0.92 HSD11B1 (0.62) THRBL3MBTL1ATMEPHX1KMT2A
SCHEMBL655025 0.92 HSD11B1 (0.62) THRBL3MBTL1ATMEPHX1KMT2A
SCHEMBL13779840 0.88 EPHX1 (0.50) THRBL3MBTL1ATMEPHX1KMT2A
SCHEMBL18926997 0.88 EPHX1 (0.70) L3MBTL1EPHX1ALDH1A1CYP2C9HSD11B1
SCHEMBL2695461 0.87 GAA (0.55) THRBL3MBTL1ATMEPHX1KMT2A
SCHEMBL28521207 0.86 EPHX1 (0.60) L3MBTL1EPHX1ALDH1A1CYP2C9HSD11B1
SCHEMBL29150085 0.86 THRB (0.54) THRBL3MBTL1ATMEPHX1KMT2A
SCHEMBL16152211 0.84 L3MBTL1 (0.62) THRBL3MBTL1ATMKMT2AMEN1
SCHEMBL2980638 0.84 EPHX1 (0.55) THRBL3MBTL1ATMEPHX1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113607831-B Detection method of 4-Boc-aminopiperidine related substance 河北国龙制药有限公司 2022-04-08 CN claimed
CN-113607831-A Detection method of 4-Boc-aminopiperidine related substance 河北国龙制药有限公司 2021-11-05 CN claimed
CN-113607831-B Detection method of 4-Boc-aminopiperidine related substance 河北国龙制药有限公司 2022-04-08 CN disclosed
CN-113607831-A Detection method of 4-Boc-aminopiperidine related substance 河北国龙制药有限公司 2021-11-05 CN disclosed
EP-1497269-B1 SUBSTITUTED 2-PHENYL-3(2H)-PYRIDAZINONES BAYER HEALTHCARE AG (DE) 2008-04-23 EP disclosed
EP-1497269-B1 SUBSTITUTED 2-PHENYL-3(2H)-PYRIDAZINONES BAYER HEALTHCARE AG (DE) 2008-04-23 EP disclosed
US-7320977-B2 Fibrotic disorders; disorders characterized by harmful buildup of collagen and/or by excessive lysyl oxidase enzymatic activity BAYER HEALTHCARE AG (DE) 2008-01-22 US disclosed
US-7320977-B2 Fibrotic disorders; disorders characterized by harmful buildup of collagen and/or by excessive lysyl oxidase enzymatic activity BAYER HEALTHCARE AG (DE) 2008-01-22 US disclosed
US-7320977-B2 Fibrotic disorders; disorders characterized by harmful buildup of collagen and/or by excessive lysyl oxidase enzymatic activity BAYER HEALTHCARE AG (DE) 2008-01-22 US disclosed
US-20060004015-A1 Substituted 2-phenyl-3(2h)-pyridazinones BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) 2006-01-05 US disclosed
EP-1497269-A1 SUBSTITUTED 2-PHENYL-3(2H)-PYRIDAZINONES Bayer HealthCare AG (DE) 2005-01-19 EP disclosed
WO-2003097612-A1 SUBSTITUTED 2-PHENYL-3(2H)-PYRIDAZINONES BAYER HEALTHCARE AG (DE) 2003-11-27 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-20060004015-A1 Substituted 2-phenyl-3(2h)-pyridazinones PIR, TPMT, PNPO THRB 2289/4885L3MBTL1 2051/4885ATM 3385/4885

“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.