SCHEMBL8068129

SCHEMBL8068129

C=C(C)C(=O)OCCO.O=C1C=C(OC2=CC(=O)c3ccccc3C2=O)C(=O)c2ccccc21

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ GAPDH P04406 3/20 0.47
▸ CDC25B P30305 4/20 0.46
▸ CDC25A P30304 3/20 0.46
▸ IDO1 P14902 2/20 0.46
▸ PTPN1 P18031 2/20 0.43
▸ S100A4 P26447 2/20 0.42
▸ PTPRC P08575 2/20 0.37
▸ APEX1 P27695 2/20 0.36
▸ MAOA P21397 2/20 0.36
▸ MAOB P27338 2/20 0.36
▸ MEN1 O00255 2/20 0.36
▸ KMT2A Q03164 2/20 0.36
▸ PLIN1 O60240 1/20 0.36
▸ NR1I2 O75469 1/20 0.36
▸ USP2 O75604 1/20 0.36
▸ ALDH1A1 P00352 1/20 0.36
▸ GSR P00390 1/20 0.36
▸ LMNA P02545 1/20 0.36
▸ TP53 P04637 1/20 0.36
▸ CYP1A2 P05177 1/20 0.36

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
Phthalic Anhydride SCHEMBL4449505 0.77 ALDH1A1 (0.46) APEX1KMT2AALDH1A1MAPK1POLB
SCHEMBL8064482 0.77 KCNA3 (0.43) MAOAMEN1KMT2AUSP2ALDH1A1
Diphenylether SCHEMBL8065399 0.74 POLB (0.48) APEX1ALDH1A1HPGDSMN1; SMN2NPC1
Benzene SCHEMBL28116485 0.72 THRB (0.53) APEX1ALDH1A1MAPTPOLBHTT
Biphenyl SCHEMBL8063223 0.72 POLB (0.46) APEX1ALDH1A1GAAMAPTSMN1; SMN2
Phenol SCHEMBL28875314 0.72 TDP1 (0.46) APEX1ALDH1A1LMNAGAAMAPT
Toluene SCHEMBL11225215 0.72 POLB (0.46) APEX1MEN1KMT2AALDH1A1LMNA
SCHEMBL8063412 0.71 POLB (0.40) APEX1KMT2AALDH1A1CYP1A2CYP2C19
Phthalic Acid SCHEMBL30229511 0.71 TDP1 (0.48) APEX1KMT2AUSP2ALDH1A1TP53
Phthalic Acid SCHEMBL17184272 0.71 TDP1 (0.48) APEX1KMT2AUSP2ALDH1A1TP53

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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