SCHEMBL2199890

SCHEMBL2199890

COCCOC(C)Oc1ccccc1-c1cc(C(N)=O)c(NC(N)=O)[nH]1

nearest known ligand 0.42

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
BRD4 O60885 5/20 0.42
CDC7 O00311 1/20 0.37
CHUK O15111 2/20 0.37
INSR P06213 2/20 0.37
MAPK8 P45983 2/20 0.37
CAMKK2 Q96RR4 2/20 0.37
IRAK4 Q9NWZ3 2/20 0.36
HTT P42858 1/20 0.35
CHEK1 O14757 2/20 0.35
MAP2 P11137 2/20 0.34
BRPF1 P55201 1/20 0.34
IKBKB O14920 1/20 0.34
EGFR P00533 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
SCHEMBL13685462 0.88 BRD4 (0.47) BRD4CDC7CHUKINSRMAPK8
SCHEMBL2199893 0.86 BRD4 (0.42) BRD4CDC7CHUKINSRMAPK8
SCHEMBL2200493 0.85 BRD4 (0.46) BRD4CDC7CHUKINSRMAPK8
SCHEMBL2199883 0.82 CHEK1 (0.45) BRD4CDC7CHUKINSRMAPK8
SCHEMBL2196927 0.80 CDC7 (0.54) BRD4CDC7CHUKINSRMAPK8
SCHEMBL2201344 0.79 HTT (0.57) BRD4CDC7CHUKINSRMAPK8
SCHEMBL2198470 0.78 BRD4 (0.47) BRD4CDC7CHUKINSRMAPK8
SCHEMBL2197555 0.77 BRD4 (0.49) BRD4CDC7CHUKINSRMAPK8
SCHEMBL4348642 0.77 BRD4 (0.41) BRD4CDC7CHUKINSRMAPK8
SCHEMBL4344137 0.77 BRD4 (0.43) BRD4CDC7CHUKINSRMAPK8

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7977371-B2 Pyrrole derivative having ureido group and aminocarbonyl group as substituents SANTEN PHARMACEUTICAL CO., LTD. (JP) 2011-07-12 US disclosed
US-20100099675-A1 NOVEL PYRROLE DERIVATIVE HAVING UREIDO GROUP AND AMINOCARBONYL GROUP AS SUBSTITUENTS SANTEN PHARMACEUTICAL CO., LTD. (JP) 2010-04-22 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-20100099675-A1 NOVEL PYRROLE DERIVATIVE HAVING UREIDO GROUP AND AMINOCARBONYL GROUP AS SUBSTITUENTS UACA, IL6, IL6ST BRD4 497/4885CDC7 4329/4885CHUK 26/4885

“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.