SCHEMBL5480869

SCHEMBL5480869

NNC(=O)c1ccc(-c2ccc(O)cc2)cc1

nearest known ligand 0.87

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MPO P05164 2/20 0.87
CYP3A4 P08684 2/20 0.87
KDM5A P29375 1/20 0.87
BLM P54132 1/20 0.87
GFER P55789 1/20 0.87
PMP22 Q01453 1/20 0.87
HIF1A Q16665 1/20 0.87
MAPT P10636 4/20 0.57
KDM4E B2RXH2 4/20 0.57
ALDH1A1 P00352 3/20 0.57
LMNA P02545 3/20 0.57
L3MBTL1 Q9Y468 2/20 0.57
OGG1 O15527 1/20 0.57
DEGS1 O15121 1/20 0.55
HSD17B1 P14061 1/20 0.54
CYP1A2 P05177 1/20 0.52
ADORA3 P0DMS8 1/20 0.52
CYP2D6 P10635 1/20 0.52
CYP2A6 P11509 1/20 0.52
CYP2C19 P33261 1/20 0.52

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
SCHEMBL80530 0.93 MPO (1.00) MPOCYP3A4KDM5ABLMGFER
Hydrochloric Acid SCHEMBL8386467 0.91 MPO (0.95) MPOCYP3A4KDM5ABLMGFER
SCHEMBL752600 0.91 MPO (0.70) MPOCYP3A4KDM5ABLMGFER
SCHEMBL17044693 0.84 MPO (0.61) MPOCYP3A4KDM5ABLMGFER
SCHEMBL343630 0.83 MPO (0.80) MPOCYP3A4KDM5ABLMGFER
SCHEMBL2678949 0.83 MPO (0.80) MPOCYP3A4KDM5ABLMGFER
SCHEMBL29123184 0.83 MPO (0.80) MPOCYP3A4KDM5ABLMGFER
SCHEMBL1706875 0.83 NPC1 (0.67) MPOCYP3A4KDM5ABLMGFER
SCHEMBL9386909 0.83 MPO (0.59) MPOCYP3A4KDM5ABLMGFER
SCHEMBL28188923 0.81 MPO (0.76) MPOCYP3A4KDM5ABLMGFER

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-1679346-B1 POLYACETAL RESIN COMPOSITION POLYPLASTICS CO (JP) 2012-11-14 EP disclosed
US-20070123617-A1 Polyacetal resin composition DEUTSCHE BANK AG, NEW YORK BRANCH, AS COLLATERAL AGENT 2007-05-31 US disclosed
EP-1679346-A1 POLYACETAL RESIN COMPOSITION Polyplastics Co., Ltd. (JP) 2006-07-12 EP disclosed