SCHEMBL13003333

SCHEMBL13003333

CCNC(=O)Nc1cc(-c2cn(Cc3ccccc3C#N)c(=O)n2-c2ccc(F)cc2)ccn1

nearest known ligand 0.39

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
RIPK3 Q9Y572 3/20 0.39
MAPK1 P28482 3/20 0.38
NR3C2 P08235 3/20 0.37
GRIN1 Q05586 2/20 0.37
GRIN2B Q13224 2/20 0.37
BUB1 O43683 2/20 0.37
MAPT P10636 1/20 0.35
ABL1 P00519 1/20 0.35
USP7 Q93009 1/20 0.35
MAPK10 P53779 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
SCHEMBL753472 0.89 RIPK3 (0.39) RIPK3NR3C2GRIN1GRIN2BMAPT
SCHEMBL752215 0.82 MAPK14 (0.47) MAPK10
SCHEMBL750203 0.82 GRIN1 (0.40) GRIN1GRIN2B
SCHEMBL751894 0.81 USP7 (0.38) RIPK3GRIN1GRIN2BMAPTUSP7
SCHEMBL752508 0.81 RIPK3 (0.46) RIPK3GRIN1GRIN2BMAPTUSP7
SCHEMBL750843 0.80 MAPK14 (0.42) RIPK3GRIN1GRIN2B
SCHEMBL749861 0.80 TSHR (0.37) RIPK3GRIN1GRIN2BMAPTUSP7
SCHEMBL750140 0.72 MAPT (0.35) MAPK1GRIN1GRIN2BMAPTUSP7
SCHEMBL12714509 0.71 TP53 (0.33) GRIN1GRIN2BMAPTUSP7
SCHEMBL13003290 0.71 MAPK14 (0.40) NR3C2GRIN2BMAPK10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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 RIPK3 1808/4885MAPK1 1284/4885NR3C2 3/4885

“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.