SCHEMBL431059

SCHEMBL431059

COc1cncc(C=O)c1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MKNK2 Q9HBH9 2/20 0.58
ROCK2 O75116 1/20 0.58
MAP4K4 O95819 1/20 0.58
PRKACA P17612 1/20 0.58
ROCK1 Q13464 1/20 0.58
DYRK1A Q13627 1/20 0.58
NTRK3 Q16288 1/20 0.58
PKN2 Q16513 1/20 0.58
CLK4 Q9HAZ1 1/20 0.58
STK17A Q9UEE5 1/20 0.58
ALDH1A1 P00352 4/20 0.48
CYP2A6 P11509 1/20 0.48
CYP1A1 P04798 3/20 0.41
CYP1B1 Q16678 3/20 0.41
CYP1A2 P05177 2/20 0.41
CYP3A4 P08684 1/20 0.41
CYP2C9 P11712 1/20 0.41
CYP11B1 P15538 1/20 0.41
CYP11B2 P19099 1/20 0.41
TDP1 Q9NUW8 2/20 0.40

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
SCHEMBL30577108 1.00 MKNK2 (0.58) MKNK2ROCK2MAP4K4PRKACAROCK1
SCHEMBL25404064 0.81 MKNK2 (0.59) MKNK2ROCK2MAP4K4PRKACAROCK1
SCHEMBL23320336 0.79 MKNK2 (0.58) MKNK2ROCK2MAP4K4PRKACAROCK1
SCHEMBL3884124 0.79 CHRNB2 (0.55) MKNK2ROCK2MAP4K4PRKACAROCK1
SCHEMBL17820413 0.79 CHRNB2 (0.54) MKNK2ROCK2MAP4K4PRKACAROCK1
SCHEMBL25342440 0.78 AKT1 (0.43) MKNK2ROCK2MAP4K4PRKACAROCK1
SCHEMBL22084104 0.78 MKNK2 (0.59) MKNK2ROCK2MAP4K4PRKACAROCK1
SCHEMBL2318682 0.78 MAP4K4 (0.55) MKNK2MAP4K4ALDH1A1CYP2A6CYP1A1
SCHEMBL1867623 0.78 ROCK2 (0.36) MKNK2ROCK2MAP4K4PRKACAROCK1
SCHEMBL16179885 0.77 MKNK2 (0.38) MKNK2ROCK2MAP4K4PRKACAROCK1

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 348 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113164458-B Monoacylglycerol lipase modulators 詹森药业有限公司 2024-09-13 CN claimed
CN-117431533-A Surface modification liquid for metallizing polyamide-imide filter substrate 电子科技大学 2024-01-23 CN claimed
CN-114635137-A Organic-inorganic hybrid composite corrosion inhibitor and preparation method and application thereof 华南理工大学 2022-06-17 CN claimed
CN-113164458-A Monoacylglycerol lipase modulators 詹森药业有限公司 2021-07-23 CN claimed
CN-111244543-A High-voltage lithium ion battery electrolyte additive, electrolyte, battery and formation method thereof 松山湖材料实验室 2020-06-05 CN claimed
US-12617801-B2 Tetrahydrothieno pyridine derivatives as DDRS inhibitors CHIESI FARMACEUTICI S.P.A. (IT) 2026-05-05 US disclosed
US-12577243-B2 Monoacylglycerol lipase modulators JANSSEN PHARMACEUTICA NV (BE) 2026-03-17 US disclosed
EP-4648762-A2 PPARG MODULATORS University of Florida Research Foundation, Incorporated (US) 2025-11-19 EP disclosed
US-12358929-B2 NMDA receptor modulators and uses thereof NOVARTIS AG (CH) 2025-07-15 US disclosed
US-20250215029-A1 STAT MODULATORS AND USES THEREOF RECLUDIX PHARMA, INC. 2025-07-03 US disclosed
US-12336991-B2 Factor XIIA inhibitors UNIVERSITY OF LEEDS (GB) 2025-06-24 US disclosed
EP-4313994-B1 TETRAHYDROTHIENO PYRIDINE DERIVATIVES AS DDRS INHIBITORS CHIESI FARM SPA (IT) 2025-03-05 EP disclosed
US-6579881-B2 Indoles EISAI CO., LTD. (JP) 2003-06-17 US disclosed
US-20030065018-A1 Substituted 4H-chromenes and analogs as activators of caspases and inducers of apoptosis and the use thereof CYTOVIA, INC. 2003-04-03 US disclosed
WO-2002092594-A1 SUBSTITUTED 4H-CHROMENES AND ANALOGS AS ACTIVATORS OF CASPASES AND INDUCERS OF APOPTOSIS AND THE USE THEREOF CYTOVIA, INC. (US) 2002-11-21 WO disclosed
US-6448243-B1 SEROTONIN ANTAGONIST FOR TREATING, AMELIORATING AND PREVENTING SPASTIC PARALYSIS OR CENTRAL MUSCLE RELAXANTS FOR AMELIORATING MYOTONIA EISAI CO., LTD. (JP) 2002-09-10 US disclosed
US-20020019531-A1 Indoles EISAI CO., LTD. 2002-02-14 US disclosed
EP-0976732-A1 1,4-SUBSTITUTED CYCLIC AMINE DERIVATIVES Eisai Co., Ltd. (JP) 2000-02-02 EP disclosed
EP-0244728-B1 USE OF HETEROARYLETHYL AMINES TO STIMULATE ANIMAL GROWTH, HETEROARYLETHYL AMINES AND PROCESS FOR THEIR PREPARATION BAYER AG (DE) 1992-11-11 EP disclosed
EP-0244728-A2 Use of heteroarylethyl amines to stimulate animal growth, heteroarylethyl amines and process for their preparation BAYER AG (DE) 1987-11-11 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 (7 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-20020019531-A1 Indoles INMT, MUSK, MB MKNK2 2399/4885ROCK2 215/4885MAP4K4 2493/4885
US-12617801-B2 Tetrahydrothieno pyridine derivatives as DDRS inhibitors DDR1, DDR2, DDRGK1 MKNK2 677/4885ROCK2 2074/4885MAP4K4 1742/4885
US-12577243-B2 Monoacylglycerol lipase modulators MGLL, LPL, FAAH MKNK2 4219/4885ROCK2 3548/4885MAP4K4 4353/4885
US-20250215029-A1 STAT MODULATORS AND USES THEREOF STAT6, STAT3, STAT5A MKNK2 528/4885ROCK2 912/4885MAP4K4 240/4885
US-12358929-B2 NMDA receptor modulators and uses thereof GRIN1, GRIN2A, GRIN2C MKNK2 493/4885ROCK2 4625/4885MAP4K4 1824/4885
US-12336991-B2 Factor XIIA inhibitors F11, F13B, F12 MKNK2 2408/4885ROCK2 486/4885MAP4K4 2266/4885
US-20030065018-A1 Substituted 4H-chromenes and analogs as activators of caspases and inducers of apoptosis and the use thereof CASP4, CASP5, CASP1 MKNK2 2696/4885ROCK2 1281/4885MAP4K4 944/4885

“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.