SCHEMBL6965667

SCHEMBL6965667

COc1cc(N(C)C(=O)c2cc(=O)c3ccccc3o2)cc(OC)c1OC

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 7/20 0.51
MEN1 O00255 5/20 0.51
HTT P42858 2/20 0.51
DUSP3 P51452 1/20 0.49
PTPN11 Q06124 1/20 0.49
MAPT P10636 5/20 0.49
GAA P10253 1/20 0.49
KDM4E B2RXH2 4/20 0.49
CSNK2A2 P19784 2/20 0.49
PTGS1 P23219 2/20 0.49
CSNK2B P67870 2/20 0.49
CSNK2A1 P68400 2/20 0.49
USP2 O75604 1/20 0.49
CSNK2A3 Q8NEV1 1/20 0.49
ALDH1A1 P00352 5/20 0.47
LMNA P02545 1/20 0.47
LCK P06239 1/20 0.46
MAOB P27338 1/20 0.46
SMN1; SMN2 Q16637 4/20 0.46
RAB9A P51151 3/20 0.46

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
SCHEMBL6963159 0.86 MAPT (0.57) KMT2AMEN1HTTMAPTGAA
SCHEMBL6963573 0.82 KDM4E (0.63) KMT2AMEN1HTTMAPTGAA
SCHEMBL6966261 0.78 MEN1 (0.55) KMT2AMEN1HTTMAPTGAA
SCHEMBL6952512 0.78 KMT2A (0.71) KMT2AMEN1HTTDUSP3PTPN11
SCHEMBL8661913 0.78 MAOA (0.56) KMT2AMAPTGAAKDM4EALDH1A1
SCHEMBL8642829 0.76 KMT2A (0.53) KMT2AMEN1HTTMAPTGAA
SCHEMBL28639941 0.74 KMT2A (0.69) KMT2AMEN1HTTDUSP3PTPN11
SCHEMBL29923968 0.74 KMT2A (0.69) KMT2AMEN1HTTDUSP3PTPN11
SCHEMBL6960727 0.72 MEN1 (0.54) KMT2AMEN1HTTMAPTGAA
SCHEMBL9528168 0.72 LCK (0.78) KMT2AMEN1MAPTKDM4ECSNK2A2

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-0787723-B1 CYCLOPROPACHROMENECARBOXYLATE DERIVATIVES SUNTORY LTD (JP) 2003-01-15 EP disclosed
US-5843988-A Cyclopropachromencarboxylic acid derivatives SUNTORY LIMITED (JP) 1998-12-01 US disclosed
EP-0787723-A1 CYCLOPROPACHROMENECARBOXYLATE DERIVATIVES SUNTORY LIMITED (JP) 1997-08-06 EP disclosed