SCHEMBL8064482

SCHEMBL8064482

C=C(C)C(=O)OCCO.O=C1c2ccccc2C(=O)c2c(Oc3cccc4c3C(=O)c3ccccc3C4=O)cccc21

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KCNA3 P22001 1/20 0.43
▸ ELANE P08246 3/20 0.43
▸ MEN1 O00255 4/20 0.42
▸ KMT2A Q03164 4/20 0.42
▸ PABPC1 P11940 2/20 0.42
▸ TTR P02766 3/20 0.41
▸ MAOA P21397 1/20 0.40
▸ MAPT P10636 5/20 0.38
▸ ALDH1A1 P00352 4/20 0.38
▸ L3MBTL1 Q9Y468 3/20 0.38
▸ MAPK1 P28482 3/20 0.38
▸ TDP1 Q9NUW8 3/20 0.38
▸ EGFR P00533 2/20 0.38
▸ LMNA P02545 2/20 0.38
▸ NSD2 O96028 1/20 0.38
▸ NPC1 O15118 3/20 0.37
▸ RAB9A P51151 3/20 0.37
▸ PIM1 P11309 1/20 0.37
▸ KDM4E B2RXH2 2/20 0.37
▸ SMN1; SMN2 Q16637 3/20 0.37

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
SCHEMBL8622400 0.80 TTR (0.56) KCNA3ELANEMEN1KMT2APABPC1
SCHEMBL8068131 0.77 ALDH1A1 (0.46) MEN1KMT2AMAPTALDH1A1MAPK1
SCHEMBL8068129 0.77 GAPDH (0.47) MEN1KMT2AMAOAMAPTALDH1A1
Phthalic Anhydride SCHEMBL4449505 0.76 ALDH1A1 (0.46) ELANEKMT2AALDH1A1MAPK1TDP1
SCHEMBL2840051 0.76 MAOA (0.52) MEN1KMT2APABPC1MAOAMAPT
SCHEMBL30238611 0.76 MAOA (0.52) MEN1KMT2APABPC1MAOAMAPT
SCHEMBL6415480 0.75 KCNA3 (0.57) KCNA3MEN1KMT2APABPC1TTR
SCHEMBL2266343 0.74 KCNA3 (0.68) KCNA3ELANEMEN1KMT2APABPC1
SCHEMBL2831572 0.74 MAPT (0.54) ELANEMEN1KMT2APABPC1MAOA
Benzene SCHEMBL28156555 0.73 KCNA3 (0.60) KCNA3MEN1KMT2APABPC1TTR

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-5948268-A DISSOLVING IN WATER TO BE TREATED A POLYMER FORMED FROM WATER SOLUBLE MONOMER UNITS COMPRISING A (POLY)ALKYLENE OXIDE END CAPPED WITH AN ADDITION POLYMERIZABLE GROUP AT ONE END AND AN INTENSELY FLUORESCENT GROUP AT OTHER NIPPON SHOKUBAI CO., LTD. (JP) 1999-09-07 — — US claimed
EP-0761604-B1 An agent for water treatment NIPPON CATALYTIC CHEM IND (JP) 2000-06-14 — — EP disclosed
US-5948268-A DISSOLVING IN WATER TO BE TREATED A POLYMER FORMED FROM WATER SOLUBLE MONOMER UNITS COMPRISING A (POLY)ALKYLENE OXIDE END CAPPED WITH AN ADDITION POLYMERIZABLE GROUP AT ONE END AND AN INTENSELY FLUORESCENT GROUP AT OTHER NIPPON SHOKUBAI CO., LTD. (JP) 1999-09-07 — — US disclosed
EP-0761604-A2 An agent for water treatment NIPPON SHOKUBAI CO., LTD. (JP) 1997-03-12 — — EP disclosed
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