SCHEMBL4339152

SCHEMBL4339152

NC(=O)c1cc(-c2ccccc2Cl)[nH]c1N

nearest known ligand 0.52

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
BRD4 O60885 7/20 0.52
JAK2 O60674 1/20 0.52
IKBKB O14920 2/20 0.50
PARP1 P09874 1/20 0.47
CDC7 O00311 1/20 0.42
PIK3C3 Q8NEB9 1/20 0.42
ALOX15 P16050 1/20 0.42
FFAR1 O14842 1/20 0.41
GRK6 P43250 1/20 0.41
KMT2A Q03164 1/20 0.40
ATM Q13315 1/20 0.40

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
SCHEMBL4345702 0.88 BRD4 (0.47) BRD4JAK2IKBKBPARP1CDC7
SCHEMBL4343087 0.83 JAK2 (0.53) BRD4JAK2CDC7
SCHEMBL4346833 0.81 CDC7 (0.54) BRD4PARP1CDC7FFAR1GRK6
SCHEMBL4343078 0.81 BRD4 (0.60) BRD4JAK2IKBKBCDC7FFAR1
SCHEMBL2196975 0.81 IKBKB (0.47) BRD4JAK2IKBKBPARP1FFAR1
SCHEMBL4347846 0.81 BRD4 (0.52) BRD4JAK2CDC7GRK6KMT2A
SCHEMBL12509462 0.78 BRD4 (0.49) BRD4JAK2PARP1CDC7GRK6
SCHEMBL4349024 0.78 PARP1 (0.50) BRD4JAK2PARP1CDC7FFAR1
SCHEMBL4353071 0.78 BRD4 (0.49) BRD4JAK2CDC7GRK6
SCHEMBL4339718 0.78 CDC7 (0.57) BRD4IKBKBPARP1CDC7KMT2A

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 BRD4 497/4885JAK2 256/4885IKBKB 74/4885

“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.