SCHEMBL764217

SCHEMBL764217

CC(C)(C)OC(=O)N[C@H]1CC[C@@H](C(=O)Nc2cc(-c3c[nH]c(=O)n3-c3ccc(F)cc3)ccn2)CC1

nearest known ligand 0.46

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 13/20 0.46
GSK3B P49841 12/20 0.46
MAPK10 P53779 5/20 0.45
MAPK8 P45983 4/20 0.45
GSK3A P49840 4/20 0.45
CDK1 P06493 2/20 0.45
CDK2 P24941 2/20 0.45
CDK9 P50750 2/20 0.45
CDK3 Q00526 2/20 0.45
CDK5 Q00535 2/20 0.45
CCNT1 O60563 1/20 0.45
CCNB1 P14635 1/20 0.45
CCNE1 P24864 1/20 0.45
CCNA1 P78396 1/20 0.45
CDK5R1 Q15078 1/20 0.45
MAPK9 P45984 1/20 0.42
PIK3C3 Q8NEB9 2/20 0.42

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
SCHEMBL764233 0.83 MAPK14 (0.53) MAPK14GSK3BMAPK10MAPK8GSK3A
SCHEMBL2401052 0.77 GSK3B (0.73) MAPK14GSK3BMAPK10MAPK8GSK3A
SCHEMBL2401056 0.77 GSK3B (0.73) MAPK14GSK3BMAPK10MAPK8GSK3A
SCHEMBL26015948 0.71 CDK9 (0.48) GSK3BGSK3ACDK1CDK2CDK9
SCHEMBL13060366 0.70 MAPK14 (0.48) MAPK14MAPK10
SCHEMBL765896 0.70 AXL (0.55) MAPK14GSK3BMAPK10MAPK8GSK3A
SCHEMBL30203532 0.70 CDK9 (0.61) MAPK14GSK3BMAPK10MAPK8GSK3A
SCHEMBL5216885 0.67 CHRM4 (0.53)
SCHEMBL751261 0.67 MAPK14 (0.40) MAPK14GSK3BCDK2
SCHEMBL18208382 0.67 HPGD (0.48)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1439174-B1 4-IMIDAZOLIN-2-ONE COMPOUNDS AS p38 MAP KINASE INHIBITORS MITSUBISHI TANABE PHARMA CORP (JP) 2012-03-21 EP disclosed
US-7846933-B2 such as 1-(4-Fluorophenyl)-5-(pyridin-4-yl)-4-imidazolin-2-one, having excellent p38 MAP kinase inhibitory action, useful for the treatment of osteoarthritis, arthritis, ulcerative colitis, Crohn's disease, psoriasis, dermatitis, asthma, bronchitis, pneumonia, rhinitis, conjunctivitis or keratitis MITSUBISHI TANABE PHARMA CORPORATION (JP) 2010-12-07 US disclosed
US-20090088422-A1 4-IMIDAZOLIN-2-ONE COMPOUNDS KUBO AKIRA 2009-04-02 US disclosed
US-7473695-B2 4-imidazolin-2-one compounds MITSUBISHI TANABE PHARMA CORPORATION (JP) 2009-01-06 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 (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-20090088422-A1 4-IMIDAZOLIN-2-ONE COMPOUNDS OR10J3, NR4A3, NR3C2 MAPK14 2186/4885GSK3B 3230/4885MAPK10 2070/4885

“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.