SCHEMBL130136

SCHEMBL130136

CCC(O)COc1ccc(Cc2ccc(OCC(O)COc3ccc(Cc4ccc(OCC(O)CC)cc4)cc3)cc2)cc1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.51
MAPT P10636 2/20 0.51
LMNA P02545 1/20 0.51
NPSR1 Q6W5P4 1/20 0.51
BACE1 P56817 2/20 0.48
SMN1; SMN2 Q16637 1/20 0.46
ALDH1A1 P00352 1/20 0.46
S1PR1 P21453 1/20 0.46
KMT2A Q03164 1/20 0.46
NPC1 O15118 1/20 0.46
ADRB2 P07550 3/20 0.44
ADRB1 P08588 3/20 0.44
ADRB3 P13945 2/20 0.44
PLA2G4B P0C869 1/20 0.44
PRMT5 O14744 1/20 0.44
WDR77 Q9BQA1 1/20 0.44
NR3C1 P04150 1/20 0.43
CYP2D6 P10635 1/20 0.43
ADRA1A P35348 1/20 0.43
CYP2J2 P51589 1/20 0.43

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
SCHEMBL12305419 0.98 BACE1 (0.49) POLBMAPTLMNANPSR1BACE1
SCHEMBL12895598 0.93 NQO1 (0.48) POLBMAPTLMNANPSR1BACE1
SCHEMBL4045324 0.91 BACE1 (0.58) POLBMAPTLMNABACE1SMN1; SMN2
SCHEMBL13093357 0.91 ADRB3 (0.51) POLBMAPTALDH1A1KMT2AADRB2
SCHEMBL12895597 0.91 LMNA (0.53) POLBMAPTLMNANPSR1BACE1
SCHEMBL19001619 0.90 AR (0.52) POLBMAPTLMNANPSR1BACE1
SCHEMBL12134359 0.89 NQO1 (0.52) POLBMAPTLMNANPSR1BACE1
SCHEMBL29620677 0.88 MAPT (0.57) POLBMAPTLMNANPSR1SMN1; SMN2
SCHEMBL11700114 0.87 ALDH1A1 (0.52) POLBMAPTLMNANPSR1ALDH1A1
SCHEMBL129112 0.85 CASR (0.43) POLBMAPTLMNANPSR1BACE1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8703264-B2 Optical disc DIC CORPORATION (JP) 2014-04-22 US disclosed
US-20120099412-A1 ULTRAVIOLET CURABLE COMPOSITION FOR OPTICAL DISC AND OPTICAL DISC DIC CORPORATION (JP) 2012-04-26 US disclosed
US-20120060175-A1 OPTICAL DISC DIC CORPORATION (JP) 2012-03-08 US disclosed
US-20110033650-A1 ULTRAVIOLET-CURABLE COMPOSITION FOR LIGHT-TRANSMISSION LAYER AND OPTICAL DISK DIC CORPORATION (JP) 2011-02-10 US disclosed
US-20100075100-A1 ULTRAVIOLET-CURABLE COMPOSITION FOR OPTICAL DISK, AND OPTICAL DISK DIC CORPORATION (JP) 2010-03-25 US disclosed
US-20090324870-A1 Utraviolet-curable composition for optical disk and optical disk DIC CORPORATION (JP) 2009-12-31 US disclosed