SCHEMBL2200384

SCHEMBL2200384

COc1ccc([N+](=O)[O-])cc1-c1cc(C(N)=O)c(NC(N)=O)[nH]1

nearest known ligand 0.46

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 4/20 0.45
KMT2A Q03164 4/20 0.45
MAPT P10636 3/20 0.45
POLB P06746 2/20 0.45
MAPK1 P28482 2/20 0.45
BLM P54132 1/20 0.45
HTT P42858 4/20 0.44
PKM P14618 2/20 0.44
TDP1 Q9NUW8 1/20 0.44
KCNMA1 Q12791 2/20 0.43
GRK6 P43250 1/20 0.43
LMNA P02545 1/20 0.42
ALDH1A1 P00352 2/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
SETD7 Q8WTS6 1/20 0.42
ALOX5 P09917 1/20 0.41
THRB P10828 1/20 0.41
CRHBP P24387 1/20 0.41
CRHR2 Q13324 1/20 0.41

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
SCHEMBL4347568 0.85 TDP1 (0.50) MEN1KMT2AMAPTPOLBMAPK1
SCHEMBL2197115 0.82 ADORA3 (0.44) MAPTMAPK1HTTALDH1A1
SCHEMBL13630645 0.82 BRD4 (0.52) MEN1KMT2ALMNAALDH1A1
SCHEMBL12509464 0.82 MAPK8 (0.43) MEN1KMT2AMAPTPOLBKCNMA1
SCHEMBL2197511 0.81 BRD4 (0.46)
SCHEMBL2200930 0.81 JAK2 (0.52) MEN1KMT2AMAPTPOLBHTT
SCHEMBL2196927 0.80 CDC7 (0.54) MEN1KMT2AMAPTALDH1A1SMN1; SMN2
SCHEMBL12509465 0.80 CDC7 (0.42) MEN1KMT2AMAPTLMNA
SCHEMBL2203016 0.78 CDC7 (0.60) MEN1KMT2AMAPTPOLBLMNA
SCHEMBL12509581 0.77 BRD4 (0.38) MEN1KMT2APKMLMNASMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2116530-B1 NOVEL PYRROLE DERIVATIVE HAVING UREIDE GROUP AND AMINOCARBONYL GROUP AS SUBSTITUENTS SANTEN PHARMACEUTICAL CO LTD (JP) 2012-11-14 EP disclosed
US-7977371-B2 Pyrrole derivative having ureido group and aminocarbonyl group as substituents SANTEN PHARMACEUTICAL CO., LTD. (JP) 2011-07-12 US disclosed
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
US-20100099675-A1 NOVEL PYRROLE DERIVATIVE HAVING UREIDO GROUP AND AMINOCARBONYL GROUP AS SUBSTITUENTS SANTEN PHARMACEUTICAL CO., LTD. (JP) 2010-04-22 US disclosed
EP-2116530-A1 NOVEL PYRROLE DERIVATIVE HAVING UREIDE GROUP AND AMINOCARBONYL GROUP AS SUBSTITUENTS Santen Pharmaceutical Co., Ltd (JP) 2009-11-11 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 (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 MEN1 4817/4885KMT2A 4098/4885MAPT 3737/4885

“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.