SCHEMBL2359541

SCHEMBL2359541

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

nearest known ligand 0.66

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
NR3C2 P08235 6/20 0.66
MET P08581 4/20 0.34
AXL P30530 4/20 0.34
TYRO3 Q06418 4/20 0.34
MERTK Q12866 4/20 0.34
NPC1 O15118 1/20 0.34
RAB9A P51151 1/20 0.34
KIT P10721 1/20 0.33
RORC P51449 1/20 0.32
GPR6 P46095 1/20 0.32
ALDH1A1 P00352 2/20 0.32
LMNA P02545 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
ELANE P08246 1/20 0.32
UGCG Q16739 1/20 0.32

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
SCHEMBL2358756 0.94 NR3C2 (0.66) NR3C2METAXLTYRO3MERTK
SCHEMBL27997474 0.94 NR3C2 (0.66) NR3C2METAXLTYRO3MERTK
SCHEMBL2544782 0.92 NR3C2 (0.64) NR3C2NPC1RAB9AALDH1A1LMNA
SCHEMBL2359163 0.90 NR3C2 (0.81) NR3C2KITGPR6ALDH1A1
SCHEMBL27997692 0.90 NR3C2 (0.81) NR3C2KITGPR6ALDH1A1
SCHEMBL2357968 0.88 NR3C2 (0.57) NR3C2METAXLTYRO3MERTK
SCHEMBL16456938 0.88 NR3C2 (0.58) NR3C2METAXLNPC1RAB9A
SCHEMBL2358002 0.87 NR3C2 (0.62) NR3C2NPC1RAB9AALDH1A1LMNA
SCHEMBL2548279 0.85 NR3C2 (0.67) NR3C2METAXLTYRO3MERTK
SCHEMBL2357844 0.84 NR3C2 (0.83) NR3C2KITGPR6ALDH1A1

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
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

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 3/4885MET 1727/4885AXL 1234/4885

“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.