SCHEMBL6973290

SCHEMBL6973290

O=C(CC(=O)C1CCN(C(=O)c2ccccc2)CC1)c1ccccc1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 1/20 0.61
EPHX2 P34913 1/20 0.60
ACHE P22303 1/20 0.58
PTPN2 P17706 1/20 0.57
PTPN1 P18031 1/20 0.57
ALDH1A1 P00352 2/20 0.56
MEN1 O00255 3/20 0.56
KMT2A Q03164 3/20 0.56
MGLL Q99685 2/20 0.56
HSD11B1 P28845 1/20 0.56
L3MBTL3 Q96JM7 1/20 0.54
L3MBTL1 Q9Y468 1/20 0.54
SMN1; SMN2 Q16637 3/20 0.54
LMNA P02545 2/20 0.52
HTR1A P08908 1/20 0.52
HTR1B P28222 1/20 0.52
HTR2A P28223 1/20 0.52
HTR2C P28335 1/20 0.52
HTR2B P41595 1/20 0.52
HPGD P15428 2/20 0.51

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
SCHEMBL6981291 0.92 MGLL (0.70) EPHX1EPHX2MEN1KMT2AMGLL
SCHEMBL6976855 0.89 GAA (0.67) EPHX2ACHEALDH1A1KMT2AMGLL
SCHEMBL4251157 0.84 MEN1 (0.61) PTPN1ALDH1A1MEN1KMT2AL3MBTL1
SCHEMBL9722483 0.84 MEN1 (0.61) PTPN1ALDH1A1MEN1KMT2AL3MBTL1
SCHEMBL24663619 0.83 ACHE (0.64) EPHX1EPHX2ACHEPTPN2PTPN1
SCHEMBL7499151 0.83 ACHE (0.59) EPHX1EPHX2ACHEPTPN2PTPN1
SCHEMBL6972961 0.81 KMT2A (0.55) EPHX1EPHX2ACHEPTPN2PTPN1
SCHEMBL1673861 0.80 MAPT (0.73) EPHX1EPHX2ACHEPTPN2PTPN1
SCHEMBL11788960 0.80 HPGD (0.57) EPHX2PTPN1ALDH1A1MEN1KMT2A
SCHEMBL17875071 0.80 EPHX1 (0.78) EPHX1EPHX2ACHEPTPN2PTPN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0892795-B1 PIPERIDINYLPYRAMIDINE DERIVATIVES SUMITOMO PHARMA (JP) 2003-01-08 EP disclosed
EP-0892795-A1 PIPERIDINYLPYRAMIDINE DERIVATIVES SUMITOMO PHARMACEUTICALS COMPANY, LIMITED (JP) 1999-01-27 EP disclosed
WO-1997038992-A1 PIPERIDINYLPYRAMIDINE DERIVATIVES SUMITOMO PHARMACEUTICALS COMPANY, LIMITED (JP) 1997-10-23 WO disclosed