SCHEMBL16458357

SCHEMBL16458357

Cc1c(C(=O)Nc2ccc(S(C)(=O)=O)cc2)cc(CCOCc2ccccc2)n1-c1ccc(F)cc1OC(C)(F)F

nearest known ligand 0.61

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
NR3C2 P08235 7/20 0.61
TRPV4 Q9HBA0 1/20 0.37
ALDH1A1 P00352 1/20 0.37
LMNA P02545 1/20 0.37
HTT P42858 1/20 0.37
AVPR2 P30518 1/20 0.35
GPR27 Q9NS67 1/20 0.35
PTGER1 P34995 1/20 0.34
GPR6 P46095 1/20 0.34
MET P08581 1/20 0.34
AXL P30530 1/20 0.34
PTGS2 P35354 1/20 0.34
LRRK2 Q5S007 1/20 0.34
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34
UGCG Q16739 1/20 0.34
GAA P10253 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
SCHEMBL2356953 0.90 NR3C2 (0.62) NR3C2TRPV4ALDH1A1LMNAHTT
SCHEMBL16458360 0.88 NR3C2 (0.68) NR3C2TRPV4ALDH1A1LMNAHTT
SCHEMBL16458359 0.88 NR3C2 (0.64) NR3C2ALDH1A1LMNAHTTAVPR2
SCHEMBL16457201 0.88 NR3C2 (0.58) NR3C2ALDH1A1LMNAHTTAVPR2
SCHEMBL2359546 0.85 NR3C2 (0.61) NR3C2TRPV4ALDH1A1LMNAHTT
SCHEMBL27997510 0.83 NR3C2 (0.51) NR3C2TRPV4ALDH1A1LMNAHTT
SCHEMBL2359492 0.83 NR3C2 (0.75) NR3C2TRPV4ALDH1A1LMNAHTT
SCHEMBL16456985 0.83 NR3C2 (0.58) NR3C2LMNAAVPR2GPR27PTGS2
SCHEMBL16456919 0.82 NR3C2 (0.59) NR3C2ALDH1A1LMNAHTTAVPR2
SCHEMBL16457018 0.82 NR3C2 (0.59) NR3C2ALDH1A1LMNAHTTAVPR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2349996-B1 1-PHENYLPYRROLE COMPOUNDS EXELIXIS INC (US) 2014-01-01 EP disclosed