SCHEMBL2961758

SCHEMBL2961758

COc1cc(CC(=O)NC2CCC(C3CCCCC3)CC2)ccc1O

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 1/20 0.56
GFER P55789 1/20 0.53
SIGMAR1 Q99720 1/20 0.53
TDP1 Q9NUW8 2/20 0.52
ALDH1A1 P00352 2/20 0.52
GAA P10253 2/20 0.52
TSHR P16473 1/20 0.52
NFKB1 P19838 1/20 0.52
KDM4E B2RXH2 1/20 0.52
ALOX15 P16050 1/20 0.52
NPC1 O15118 2/20 0.51
RAB9A P51151 2/20 0.51
PTPN7 P35236 2/20 0.51
DUSP3 P51452 2/20 0.51
LMNA P02545 1/20 0.51
MAPT P10636 1/20 0.51
HPGD P15428 1/20 0.51
MEN1 O00255 4/20 0.51
KMT2A Q03164 4/20 0.51
HTT P42858 1/20 0.48

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
SCHEMBL2961754 1.00 EPHX2 (0.56) EPHX2GFERSIGMAR1TDP1ALDH1A1
SCHEMBL2960831 1.00 EPHX2 (0.56) EPHX2GFERSIGMAR1TDP1ALDH1A1
SCHEMBL2960830 1.00 EPHX2 (0.56) EPHX2GFERSIGMAR1TDP1ALDH1A1
SCHEMBL2961034 0.96 SIGMAR1 (0.54) EPHX2GFERSIGMAR1TDP1ALDH1A1
SCHEMBL2961037 0.96 SIGMAR1 (0.54) EPHX2GFERSIGMAR1TDP1ALDH1A1
SCHEMBL9808765 0.93 EPHX2 (0.65) EPHX2GFERSIGMAR1TDP1ALDH1A1
SCHEMBL2976977 0.93 EPHX2 (0.65) EPHX2GFERSIGMAR1TDP1ALDH1A1
SCHEMBL2977052 0.87 EPHX2 (0.52) EPHX2GFERSIGMAR1TDP1ALDH1A1
SCHEMBL2977055 0.87 EPHX2 (0.52) EPHX2GFERSIGMAR1TDP1ALDH1A1
SCHEMBL9028338 0.86 GAA (0.60) EPHX2SIGMAR1TDP1ALDH1A1GAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7767854-B2 N-substituted phenylacetamide derivative and pharmaceutical composition containing the same DAINIPPON SUMITOMO PHARMA CO., LTD. (JP) 2010-08-03 US claimed
US-20090082463-A1 N-substituted phenylacetamide derivative and pharmaceutical composition containing the same DAINIPPON SUMITOMO PHARMA CO., LTD. (JP) 2009-03-26 US claimed
EP-1884510-A1 N-SUBSTITUTED PHENYLACETAMIDE DERIVATIVE AND PHARMACEUTICAL COMPOSITION COMPRISING THE SAME Dainippon Sumitomo Pharma Co., Ltd. (JP) 2008-02-06 EP claimed
US-7767854-B2 N-substituted phenylacetamide derivative and pharmaceutical composition containing the same DAINIPPON SUMITOMO PHARMA CO., LTD. (JP) 2010-08-03 US disclosed
US-7767854-B2 N-substituted phenylacetamide derivative and pharmaceutical composition containing the same DAINIPPON SUMITOMO PHARMA CO., LTD. (JP) 2010-08-03 US disclosed
US-7767854-B2 N-substituted phenylacetamide derivative and pharmaceutical composition containing the same DAINIPPON SUMITOMO PHARMA CO., LTD. (JP) 2010-08-03 US disclosed
US-20090082463-A1 N-substituted phenylacetamide derivative and pharmaceutical composition containing the same DAINIPPON SUMITOMO PHARMA CO., LTD. (JP) 2009-03-26 US disclosed
US-20090082463-A1 N-substituted phenylacetamide derivative and pharmaceutical composition containing the same DAINIPPON SUMITOMO PHARMA CO., LTD. (JP) 2009-03-26 US disclosed
US-20090082463-A1 N-substituted phenylacetamide derivative and pharmaceutical composition containing the same DAINIPPON SUMITOMO PHARMA CO., LTD. (JP) 2009-03-26 US disclosed
EP-1884510-A1 N-SUBSTITUTED PHENYLACETAMIDE DERIVATIVE AND PHARMACEUTICAL COMPOSITION COMPRISING THE SAME Dainippon Sumitomo Pharma Co., Ltd. (JP) 2008-02-06 EP disclosed
EP-1884510-A1 N-SUBSTITUTED PHENYLACETAMIDE DERIVATIVE AND PHARMACEUTICAL COMPOSITION COMPRISING THE SAME Dainippon Sumitomo Pharma Co., Ltd. (JP) 2008-02-06 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-20090082463-A1 N-substituted phenylacetamide derivative and pharmaceutical composition containing the same HRH4, HRH2, CNR2 EPHX2 1828/4885GFER 2500/4885SIGMAR1 84/4885

“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.