SCHEMBL1733547

SCHEMBL1733547

C=C(C)C(=O)c1ccc(Nc2ccccc2)c2c1C(=O)c1ccccc1C2=O

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.48
MEN1 O00255 4/20 0.48
KMT2A Q03164 4/20 0.48
CYP1A2 P05177 2/20 0.45
TSHR P16473 1/20 0.45
MAPK1 P28482 4/20 0.43
LMNA P02545 3/20 0.43
NPC1 O15118 1/20 0.43
RAB9A P51151 1/20 0.43
NPSR1 Q6W5P4 1/20 0.43
TDP1 Q9NUW8 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
P2RY12 Q9H244 5/20 0.43
SMN1; SMN2 Q16637 2/20 0.42
POLB P06746 2/20 0.42
PABPC1 P11940 1/20 0.42
NSD2 O96028 1/20 0.42
BLM P54132 1/20 0.42
RXFP1 Q9HBX9 1/20 0.42
P2RY2 P41231 5/20 0.41

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
SCHEMBL6137259 0.83 CYP1A2 (0.52) MAPTMEN1KMT2ACYP1A2TSHR
SCHEMBL13609808 0.80 CYP1A2 (0.44) MAPTMEN1KMT2ACYP1A2TSHR
SCHEMBL595104 0.80 P2RY12 (0.56) MAPTMEN1KMT2ACYP1A2TSHR
SCHEMBL12118723 0.79 MAOA (0.63) MAPTMEN1KMT2ACYP1A2TSHR
SCHEMBL14600814 0.78 P2RY12 (0.55) MAPTMEN1KMT2ACYP1A2TSHR
SCHEMBL11605977 0.76 P2RY12 (0.57) MAPTMEN1KMT2ACYP1A2TSHR
SCHEMBL30922379 0.75 MAPT (0.59) MAPTMEN1KMT2ACYP1A2TSHR
SCHEMBL139752 0.75 MAPT (0.59) MAPTMEN1KMT2ACYP1A2TSHR
SCHEMBL31150807 0.75 MAPT (0.59) MAPTMEN1KMT2ACYP1A2TSHR
SCHEMBL10789018 0.75 P2RY4 (0.60) MAPTMEN1KMT2ACYP1A2TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1832913-B1 COMPOSITE CONTACT LENS AND PRODUCTION METHOD FOR SUCH A LENS HOYA CORP (JP) 2011-11-23 EP disclosed
EP-1832913-A1 COMPOSITE CONTACT LENS AND PRODUCTION METHOD FOR LENS MATERIAL HOYA CORPORATION (JP) 2007-09-12 EP disclosed