SCHEMBL2359253

SCHEMBL2359253

Cc1c(C(=O)Nc2ccc(S(C)(=O)=O)cc2)cc(CC(=O)N(C)C)n1-c1ccc(Cl)cc1C(F)(F)F

nearest known ligand 0.77

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
NR3C2 P08235 7/20 0.77
GPR27 Q9NS67 2/20 0.46
AVPR2 P30518 1/20 0.46
CCR2 P41597 3/20 0.39
MAPT P10636 1/20 0.38
MAPK1 P28482 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38
LMNA P02545 1/20 0.38
POLB P06746 1/20 0.38
TMPRSS4 Q9NRS4 1/20 0.38
SIRT2 Q8IXJ6 2/20 0.38
RORC P51449 1/20 0.37
GAA P10253 1/20 0.37

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
SCHEMBL2357087 0.91 NR3C2 (0.81) NR3C2GPR27AVPR2MAPTMAPK1
SCHEMBL2357173 0.87 NR3C2 (1.00) NR3C2GPR27AVPR2MAPTMAPK1
SCHEMBL2358751 0.86 NR3C2 (0.80) NR3C2GPR27AVPR2MAPTMAPK1
SCHEMBL2356581 0.86 NR3C2 (1.00) NR3C2GPR27AVPR2MAPTMAPK1
SCHEMBL2357997 0.86 NR3C2 (0.87) NR3C2GPR27AVPR2MAPTMAPK1
SCHEMBL27997698 0.86 NR3C2 (0.87) NR3C2GPR27AVPR2MAPTMAPK1
SCHEMBL12279571 0.82 NR3C2 (0.77) NR3C2GPR27AVPR2MAPTMAPK1
SCHEMBL2359492 0.80 NR3C2 (0.75) NR3C2GPR27AVPR2MAPTMAPK1
SCHEMBL2548305 0.80 NR3C2 (0.75) NR3C2LMNAPOLBTMPRSS4
SCHEMBL2357088 0.80 NR3C2 (0.70) NR3C2GPR27AVPR2MAPTMAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8642640-B2 1-phenylpyrrole derivatives EXELIXIS, INC. (US) 2014-02-04 US claimed
EP-2349996-B1 1-PHENYLPYRROLE COMPOUNDS EXELIXIS INC (US) 2014-01-01 EP claimed
US-20110263544-A1 1-Phenylpyrrole Derivatives DAIICHI SANKYO COMPANY, LIMITED (JP) 2011-10-27 US claimed
EP-2349996-A1 1-PHENYLPYRROLE COMPOUNDS Exelixis, Inc. (US) 2011-08-03 EP claimed
WO-2010042626-A1 1-PHENYLPYRROLE COMPOUNDS EXELIXIS, INC. (US) 2010-04-15 WO claimed
US-8642640-B2 1-phenylpyrrole derivatives EXELIXIS, INC. (US) 2014-02-04 US disclosed
US-8642640-B2 1-phenylpyrrole derivatives EXELIXIS, INC. (US) 2014-02-04 US disclosed
US-8642640-B2 1-phenylpyrrole derivatives EXELIXIS, INC. (US) 2014-02-04 US disclosed
EP-2349996-B1 1-PHENYLPYRROLE COMPOUNDS EXELIXIS INC (US) 2014-01-01 EP disclosed
US-20110263544-A1 1-Phenylpyrrole Derivatives DAIICHI SANKYO COMPANY, LIMITED (JP) 2011-10-27 US disclosed
US-20110263544-A1 1-Phenylpyrrole Derivatives DAIICHI SANKYO COMPANY, LIMITED (JP) 2011-10-27 US disclosed
US-20110263544-A1 1-Phenylpyrrole Derivatives DAIICHI SANKYO COMPANY, LIMITED (JP) 2011-10-27 US disclosed
EP-2349996-A1 1-PHENYLPYRROLE COMPOUNDS Exelixis, Inc. (US) 2011-08-03 EP disclosed
WO-2010042626-A1 1-PHENYLPYRROLE COMPOUNDS EXELIXIS, INC. (US) 2010-04-15 WO disclosed
WO-2010042626-A1 1-PHENYLPYRROLE COMPOUNDS EXELIXIS, INC. (US) 2010-04-15 WO 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-20110263544-A1 1-Phenylpyrrole Derivatives REN, AGTR1, NR3C2 NR3C2 3/4885GPR27 637/4885AVPR2 22/4885

“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.