SCHEMBL5066637

SCHEMBL5066637

C=Cc1ccc(OC(=O)C2(C)CC3C=CC2C3)cc1

nearest known ligand 0.36

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.36
MAPT P10636 1/20 0.36
XBP1 P17861 1/20 0.36
P2RX7 Q99572 1/20 0.36
CETP P11597 1/20 0.36
HPGD P15428 3/20 0.31
LMNA P02545 1/20 0.31
TP53 P04637 1/20 0.31
POLB P06746 1/20 0.31
CHRNB2 P17787 1/20 0.30
CHRNB4 P30926 1/20 0.30
CHRNA3 P32297 1/20 0.30
CHRNA7 P36544 1/20 0.30
CHRNA4 P43681 1/20 0.30
SLC6A2 P23975 1/20 0.30
SLC6A4 P31645 1/20 0.30
SLC6A3 Q01959 1/20 0.30

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
SCHEMBL201527 0.83 P2RX7 (0.41) GAAMAPTXBP1P2RX7CETP
SCHEMBL4103952 0.81 KMT2A (0.43) GAAMAPTXBP1P2RX7CETP
SCHEMBL4100310 0.78 L3MBTL1 (0.43) MAPTP2RX7CETPHPGDPOLB
SCHEMBL15356294 0.75 ALDH1A1 (0.31) CHRNB2CHRNB4CHRNA3CHRNA7CHRNA4
SCHEMBL22894437 0.73 MAPT (0.67) GAAMAPTXBP1P2RX7HPGD
SCHEMBL5066632 0.72 P2RX7 (0.34) GAAP2RX7CETPHPGDTP53
SCHEMBL18938394 0.72 P2RX7 (0.41) MAPTP2RX7CETPLMNAPOLB
SCHEMBL200115 0.72 P2RX7 (0.41) MAPTP2RX7CETPLMNAPOLB
SCHEMBL4100519 0.69 KMT2A (0.46) GAAMAPTP2RX7CETPHPGD
SCHEMBL2190679 0.69 P2RX7 (0.36) P2RX7CETP

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1655321-B1 POLYMERIZABLE COMPOSITIONS AND MOLDED ARTICLES PRODUCED BY USING THE SAME ZEON CORP (JP) 2012-11-21 EP disclosed
US-7381782-B2 Polymerizable composition and molded articles produced by using the same ZEON CORPORATION (JP) 2008-06-03 US disclosed
US-20060258828-A1 Polymerizable composition and molded articles produced by using the same ZEON CORPORATION (JP) 2006-11-16 US disclosed
EP-1655321-A1 POLYMERIZABLE COMPOSITIONS AND MOLDED ARTICLES PRODUCED BY USING THE SAME Zeon Corporation (JP) 2006-05-10 EP disclosed