SCHEMBL8067969

SCHEMBL8067969

C=C(C)C(=O)OCCO.c1cc2ccc3ccc(Oc4ccc5ccc6cccc7ccc4c5c67)c4ccc(c1)c2c34

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 4/20 0.39
▸ HPGD P15428 4/20 0.39
▸ KDM4E B2RXH2 3/20 0.39
▸ MAPT P10636 1/20 0.39
▸ KMT2A Q03164 2/20 0.37
▸ MEN1 O00255 1/20 0.37
▸ THRB P10828 1/20 0.37
▸ POLB P06746 2/20 0.35
▸ HSD17B10 Q99714 2/20 0.35
▸ CYP1A2 P05177 1/20 0.35
▸ GLA P06280 1/20 0.35
▸ CYP2D6 P10635 1/20 0.35
▸ TDP1 Q9NUW8 2/20 0.34
▸ APEX1 P27695 1/20 0.34
▸ HTT P42858 1/20 0.34
▸ TSHR P16473 3/20 0.33
▸ CYP3A4 P08684 1/20 0.33
▸ L3MBTL1 Q9Y468 1/20 0.33
▸ CA1 P00915 3/20 0.32
▸ CA2 P00918 3/20 0.32

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
SCHEMBL8068131 0.83 ALDH1A1 (0.46) ALDH1A1HPGDKDM4EMAPTKMT2A
SCHEMBL29733292 0.80 ALDH1A1 (0.47) ALDH1A1HPGDKDM4EMAPTKMT2A
SCHEMBL13609732 0.80 ALDH1A1 (0.47) ALDH1A1HPGDKDM4EMAPTKMT2A
SCHEMBL717112 0.78 MEN1 (0.56) ALDH1A1HPGDKDM4EMAPTKMT2A
SCHEMBL28989825 0.77 MEN1 (0.54) ALDH1A1HPGDKDM4EMAPTKMT2A
SCHEMBL27898321 0.76 KMT2A (0.42) ALDH1A1HPGDKDM4EMAPTKMT2A
SCHEMBL17612596 0.76 KMT2A (0.56) ALDH1A1HPGDKDM4EMAPTKMT2A
SCHEMBL417057 0.75 KMT2A (0.51) ALDH1A1HPGDKDM4EMAPTKMT2A
SCHEMBL30542093 0.75 KMT2A (0.51) ALDH1A1HPGDKDM4EMAPTKMT2A
SCHEMBL12458556 0.74 THRB (0.44) ALDH1A1HPGDKDM4EKMT2AMEN1

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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