SCHEMBL7933560

SCHEMBL7933560

O=C1c2ccccc2-c2cccc(OCCO)c21

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KCNA3 P22001 1/20 0.59
ALDH1A1 P00352 5/20 0.47
HTT P42858 3/20 0.47
MAPT P10636 3/20 0.45
LMNA P02545 2/20 0.45
TTR P02766 1/20 0.44
MEN1 O00255 3/20 0.43
KMT2A Q03164 3/20 0.43
PTPN1 P18031 1/20 0.43
PABPC1 P11940 1/20 0.43
SMN1; SMN2 Q16637 2/20 0.42
NPC1 O15118 1/20 0.42
PTPRC P08575 1/20 0.41
KDM4E B2RXH2 3/20 0.41
USP2 O75604 1/20 0.41
DUSP3 P51452 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
EGFR P00533 1/20 0.41
PIM1 P11309 1/20 0.41
TP53 P04637 1/20 0.40

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
SCHEMBL2266343 0.93 KCNA3 (0.68) KCNA3ALDH1A1HTTMAPTLMNA
SCHEMBL17305579 0.91 KCNA3 (0.59) KCNA3ALDH1A1HTTMAPTTTR
SCHEMBL28365315 0.87 KCNA3 (0.59) KCNA3ALDH1A1HTTMAPTTTR
SCHEMBL12332436 0.86 KCNA3 (0.58) KCNA3ALDH1A1HTTMAPTLMNA
SCHEMBL28113934 0.86 ALDH1A1 (0.45) KCNA3ALDH1A1HTTMAPTLMNA
SCHEMBL15859640 0.85 KCNA3 (0.70) KCNA3ALDH1A1HTTMAPTLMNA
SCHEMBL6334029 0.84 KCNA3 (0.61) KCNA3ALDH1A1MAPTLMNATTR
SCHEMBL6334990 0.84 KCNA3 (0.61) KCNA3ALDH1A1MAPTLMNATTR
SCHEMBL6333924 0.84 KCNA3 (0.61) KCNA3ALDH1A1MAPTLMNATTR
SCHEMBL15859641 0.84 EGFR (0.60) KCNA3ALDH1A1HTTMAPTLMNA

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
US-6245922-B1 PREPARED BY REACTING AN ELECTROPHILIC 2-ALKENYL AZALACTONE WITH A NUCLEOPHILIC AROMATIC KETONE; CAN BE COPOLYMERIZED WITH ACRYLIC MONOMERS AND PHOTOACTIVATED BY ACTINIC RADIATION TO CROSSLINK THE POLYMERS 3M INNOVATIVE PROPERTIES COMPANY 2001-06-12 US disclosed
EP-0837844-B1 ACRYLAMIDE DERIVATIVES AS CHROMOPHORIC PHOTOCROSSLINKING COMPOUND MINNESOTA MINING & MFG (US) 2000-04-05 EP disclosed
EP-0837844-A1 ACRYLAMIDE DERIVATIVES AS CHROMOPHORIC PHOTOCROSSLINKING COMPOUND MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1998-04-29 EP disclosed
WO-1997005101-A1 ACRYLAMIDE DERIVATIVES AS CHROMOPHORIC PHOTOCROSSLINKING COMPOUND MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1997-02-13 WO disclosed