SCHEMBL6960727

SCHEMBL6960727

CN(C(=O)c1cc(=O)c2ccccc2o1)c1ccccn1

nearest known ligand 0.54

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 4/20 0.54
KMT2A Q03164 4/20 0.54
RAB9A P51151 3/20 0.54
TSHR P16473 1/20 0.54
CSNK2A2 P19784 5/20 0.52
CSNK2B P67870 5/20 0.52
CSNK2A1 P68400 5/20 0.52
CSNK2A3 Q8NEV1 5/20 0.52
KDM4E B2RXH2 1/20 0.52
USP2 O75604 1/20 0.52
PTGS1 P23219 1/20 0.52
MAPT P10636 5/20 0.49
GAA P10253 1/20 0.49
POLB P06746 3/20 0.48
SMN1; SMN2 Q16637 2/20 0.48
NPC1 O15118 2/20 0.48
ALDH1A1 P00352 2/20 0.48
HTT P42858 1/20 0.48
MAOB P27338 1/20 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
SCHEMBL6963573 0.80 KDM4E (0.63) MEN1KMT2ARAB9ATSHRCSNK2A2
SCHEMBL6966261 0.76 MEN1 (0.55) MEN1KMT2ARAB9ATSHRCSNK2A2
SCHEMBL24896447 0.76 ALDH1A1 (0.41) MEN1KMT2ARAB9ATSHRMAPT
SCHEMBL30220577 0.76 ALDH1A1 (0.41) MEN1KMT2ARAB9ATSHRMAPT
SCHEMBL6963159 0.74 MAPT (0.57) MEN1KMT2ARAB9ACSNK2A2CSNK2B
SCHEMBL6956603 0.73 KMT2A (0.83) MEN1KMT2ARAB9ACSNK2A2CSNK2B
SCHEMBL6965667 0.72 KMT2A (0.51) MEN1KMT2ARAB9ATSHRCSNK2A2
SCHEMBL12536148 0.72 KDM4E (0.72) MEN1KMT2ARAB9ATSHRCSNK2A2
SCHEMBL7368446 0.71 CYP2D6 (0.46) MEN1KMT2ARAB9ATSHRKDM4E
SCHEMBL24896456 0.71 TRPM8 (0.44) MEN1KMT2ARAB9AMAPTPOLB

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