SCHEMBL7002099

SCHEMBL7002099

CCc1nc(NC(=O)OC(C)(C)C)ccc1CN

nearest known ligand 0.40

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MAPKAPK2 P49137 9/20 0.40
GSK3B P49841 1/20 0.38
DYRK1A Q13627 1/20 0.38
SCN9A Q15858 1/20 0.37
CYP17A1 P05093 2/20 0.37
LCK P06239 2/20 0.36
HDAC1 Q13547 1/20 0.35
ATR Q13535 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
SCHEMBL30387136 1.00 MAPKAPK2 (0.40) MAPKAPK2GSK3BDYRK1ASCN9ACYP17A1
SCHEMBL6999990 0.91 MAPKAPK2 (0.38) MAPKAPK2GSK3BDYRK1ASCN9ACYP17A1
SCHEMBL3888187 0.85 LCK (0.39) MAPKAPK2GSK3BDYRK1ASCN9ACYP17A1
SCHEMBL23201139 0.81 GABRP (0.39)
SCHEMBL7321790 0.80 MAPKAPK2 (0.41) MAPKAPK2GSK3BDYRK1ASCN9ACYP17A1
SCHEMBL7310686 0.77 MAPKAPK2 (0.40) MAPKAPK2GSK3BDYRK1A
SCHEMBL17598745 0.76 GSK3B (0.39) MAPKAPK2GSK3BDYRK1ASCN9ALCK
SCHEMBL5345817 0.75 MAPKAPK2 (0.41) MAPKAPK2GSK3BDYRK1ASCN9ACYP17A1
SCHEMBL29112758 0.75 CNR2 (0.41) MAPKAPK2GSK3BDYRK1ASCN9ACYP17A1
SCHEMBL6059352 0.75 LCK (0.40) MAPKAPK2GSK3BDYRK1ASCN9ACYP17A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230145071-A1 MASP-2 INHIBITORS AND METHODS OF USE OMEROS CORPORATION 2023-05-11 US disclosed
US-11584714-B2 MASP-2 inhibitors and methods of use OMEROS CORPORATION (US) 2023-02-21 US disclosed
EP-1069132-B1 Bicyclic derivatives of amino-pyrazinones, process of preparation and pharmaceutical compositions comprising them SERVIER LAB (FR) 2003-10-01 EP disclosed
US-6277851-B1 ORALLY ADMINISTERED TRYPSIN-RELATED SERINE PROTEASE INHIBITORS; ANTICOAGULANTS ADIR ET COMPAGNIE (FR) 2001-08-21 US disclosed
EP-1069132-A1 Bicyclic derivatives of amino-pyrazinones, process of preparation and pharmaceutical compositions comprising them ADIR ET COMPAGNIE (FR) 2001-01-17 EP disclosed
EP-0835109-A4 PYRIDINONE-THROMBIN INHIBITORS MERCK & CO INC (US) 1999-02-03 EP disclosed
US-5744486-A Pyridinone thrombin inhibitors MERCK & CO., INC. (US) 1998-04-28 US disclosed
EP-0835109-A1 PYRIDINONE-THROMBIN INHIBITORS Merck & Co., Inc. (US) 1998-04-15 EP disclosed
US-5668289-A Pyridinone thrombin inhibitors MERCK & CO., INC. (US) 1997-09-16 US disclosed
WO-1997001338-A1 PYRIDINONE-THROMBIN INHIBITORS MERCK & CO., INC. (US) 1997-01-16 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 (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-11584714-B2 MASP-2 inhibitors and methods of use MASP2, METAP2, SPINT2 MAPKAPK2 143/4885GSK3B 4143/4885DYRK1A 3550/4885
US-20230145071-A1 MASP-2 INHIBITORS AND METHODS OF USE MASP2, METAP2, SPINT2 MAPKAPK2 143/4885GSK3B 4143/4885DYRK1A 3550/4885

“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.