SCHEMBL2543882

SCHEMBL2543882

Cc1c(C(=O)Nc2ccc(S(N)(=O)=O)c(Cl)c2)cc(C[C@H](C)O)n1-c1ccc(F)cc1OC(F)(F)F

nearest known ligand 0.52

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
NR3C2 P08235 5/20 0.52
PNLIP P16233 1/20 0.36
KCNK3 O14649 2/20 0.35
KCNK9 Q9NPC2 2/20 0.35

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
SCHEMBL2547117 0.93 NR3C2 (0.58) NR3C2PNLIP
SCHEMBL2360202 0.89 NR3C2 (0.58) NR3C2
SCHEMBL2358468 0.89 NR3C2 (0.64) NR3C2
SCHEMBL2357191 0.87 NR3C2 (0.58) NR3C2PNLIPKCNK3KCNK9
SCHEMBL2357097 0.84 NR3C2 (0.67) NR3C2KCNK3KCNK9
SCHEMBL2544782 0.83 NR3C2 (0.64) NR3C2
SCHEMBL2551428 0.83 NR3C2 (0.74) NR3C2
SCHEMBL2360115 0.82 NR3C2 (0.63) NR3C2PNLIPKCNK3KCNK9
SCHEMBL2359528 0.82 NR3C2 (0.63) NR3C2
SCHEMBL2550462 0.82 NR3C2 (0.69) NR3C2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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
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
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 3/4885PNLIP 1430/4885KCNK3 1187/4885

“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.