SCHEMBL4347703

SCHEMBL4347703

NC(=O)Nc1[nH]c(-c2cccc(-c3ccoc3)c2)cc1C(N)=O

nearest known ligand 0.42

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 1/20 0.42
BRD4 O60885 1/20 0.40
SERPINE1 P05121 4/20 0.39
CDC7 O00311 5/20 0.39
HDAC2 Q92769 1/20 0.39
IKBKB O14920 2/20 0.38
JAK2 O60674 1/20 0.38
JAK3 P52333 1/20 0.38
CCNA2 P20248 1/20 0.36
CDK2 P24941 1/20 0.36
CCNA1 P78396 1/20 0.36
PTGER2 P43116 1/20 0.35
HDAC1 Q13547 1/20 0.35
KIF11 P52732 1/20 0.34
PTGES2 Q9H7Z7 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
SCHEMBL12424010 0.90 PTGER2 (0.42) BRD4CDC7HDAC2IKBKBJAK2
SCHEMBL2199518 0.89 PTGER2 (0.40) BRD4CDC7HDAC2CCNA2CDK2
SCHEMBL12509786 0.81 BRD4 (0.44) BRD4CDC7IKBKBJAK2JAK3
SCHEMBL2199605 0.79 PARP1 (0.47) BRD4CDC7IKBKBJAK2JAK3
SCHEMBL2200000 0.79 IKBKB (0.51) BRD4CDC7IKBKBJAK2JAK3
SCHEMBL2200146 0.79 BRD4 (0.62) BRD4CDC7IKBKBJAK2JAK3
SCHEMBL2199810 0.78 CDC7 (0.56) BRD4CDC7IKBKBJAK2JAK3
SCHEMBL2196489 0.78 IKBKB (0.52) BRD4IKBKBJAK2JAK3
SCHEMBL2199237 0.78 CDC7 (0.56) BRD4CDC7IKBKBJAK2JAK3
SCHEMBL2196883 0.78 CDC7 (0.56) BRD4CDC7IKBKBJAK2JAK3

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 7 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
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 CNR1 195/4885BRD4 497/4885SERPINE1 639/4885

“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.