SCHEMBL2746896

SCHEMBL2746896

CC(C)(N)C(=O)NCCN1CCOCC1

nearest known ligand 0.59

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.59
TDP1 Q9NUW8 1/20 0.54
TSHR P16473 2/20 0.51
MAPT P10636 1/20 0.51
CD274 Q9NZQ7 3/20 0.50
SMN1; SMN2 Q16637 1/20 0.50
GAA P10253 1/20 0.49
CA12 O43570 1/20 0.49
CA1 P00915 1/20 0.49
CA2 P00918 1/20 0.49
CA9 Q16790 1/20 0.49
HPGD P15428 1/20 0.48
POLB P06746 1/20 0.48
KDM4E B2RXH2 1/20 0.48

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
SCHEMBL2698834 0.87 LMNA (0.62) LMNATDP1TSHRMAPTSMN1; SMN2
SCHEMBL21244056 0.85 CA12 (0.50) LMNACA12CA1CA2CA9
SCHEMBL24029781 0.83 HDAC2 (0.48) LMNATSHRPOLB
Hydrochloric Acid SCHEMBL22729331 0.83 KMT2A (0.49) LMNASMN1; SMN2CA12CA1CA2
SCHEMBL14640548 0.83 DRD2 (0.59) LMNATDP1TSHRMAPTSMN1; SMN2
SCHEMBL3826134 0.83 LMNA (0.61) LMNATDP1TSHRMAPTCD274
SCHEMBL13985634 0.81 LMNA (0.56) LMNATDP1TSHRMAPTCD274
SCHEMBL10265328 0.81 LMNA (0.56) LMNATDP1TSHRMAPTSMN1; SMN2
SCHEMBL13915561 0.81 TDP1 (0.58) LMNATDP1TSHRMAPTSMN1; SMN2
SCHEMBL20243887 0.80 DRD2 (0.60) LMNATDP1TSHRSMN1; SMN2CA12

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8367666-B2 3-carbamoyl-2-pyridone derivatives SHIONOGI & CO., LTD. (JP) 2013-02-05 US disclosed
US-20120208813-A1 3-CARBAMOYL-2-PYRIDONE DERIVATIVES SHIONOGI & CO., LTD. 2012-08-16 US disclosed
US-8178681-B2 methyl 3-methyl-2-{[2-oxo-1-(2-oxo-ethyl)-1,2,5,6,7,8,9,10-octahydro-cycloocta[b]pyridine-3-carbonyl]-amino}-butyrate; cannabinoid receptor agonist; antiinflammatory agent, immunostimulant, analgesic; atopic dermatitis; excellent in photostability, and have excellent transdermal and oral absorbency SHIONOGI & CO., LTD. (JP) 2012-05-15 US disclosed
US-20080103139-A1 3-Carbamoyl-2-Pyridone Derivative SHIONOGI & CO. LTD. (JP) 2008-05-01 US disclosed
EP-1806342-A1 3-CARBAMOYL-2-PYRIDONE DERIVATIVE SHIONOGI & CO., LTD. (JP) 2007-07-11 EP 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-20120208813-A1 3-CARBAMOYL-2-PYRIDONE DERIVATIVES CNR2, CNR1, HRH4 LMNA 4280/4885TDP1 4135/4885TSHR 1412/4885
US-20080103139-A1 3-Carbamoyl-2-Pyridone Derivative CNR1, CNR2, HRH4 LMNA 3604/4885TDP1 4197/4885TSHR 1109/4885

“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.