SCHEMBL5506364

SCHEMBL5506364

C=C(C)C(=O)Oc1cccc(C(=O)O)c1C(=O)c1ccccc1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ELANE P08246 3/20 0.57
KDM4E B2RXH2 6/20 0.53
HSD17B10 Q99714 5/20 0.53
HPGD P15428 4/20 0.53
ALDH1A1 P00352 3/20 0.53
TDP1 Q9NUW8 2/20 0.53
ESR1 P03372 1/20 0.53
ITGB3 P05106 1/20 0.53
ITGA2B P08514 1/20 0.53
HMGB1 P09429 1/20 0.53
TSHR P16473 1/20 0.53
GGT1 P19440 1/20 0.53
PTGS1 P23219 1/20 0.53
PTGS2 P35354 1/20 0.53
BLM P54132 1/20 0.53
NAPRT Q6XQN6 1/20 0.53
MAPK1 P28482 2/20 0.49
LMNA P02545 1/20 0.48
CYP1A2 P05177 1/20 0.48
CYP2C9 P11712 1/20 0.48

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 Acid SCHEMBL27855768 0.88 KDM4E (0.51) ELANEKDM4EHSD17B10HPGDALDH1A1
SCHEMBL4863253 0.88 KDM4E (0.50) ELANEKDM4EHSD17B10HPGDALDH1A1
SCHEMBL29670258 0.84 ELANE (0.64) ELANEKDM4EHSD17B10HPGDALDH1A1
SCHEMBL474811 0.84 ELANE (0.64) ELANEKDM4EHSD17B10HPGDALDH1A1
SCHEMBL29981543 0.82 KDM4E (0.70) ELANEKDM4EHSD17B10HPGDALDH1A1
SCHEMBL16966572 0.82 KDM4E (0.70) ELANEKDM4EHSD17B10HPGDALDH1A1
SCHEMBL344654 0.82 KDM4E (0.70) ELANEKDM4EHSD17B10HPGDALDH1A1
SCHEMBL10662113 0.82 ELANE (0.57) ELANEKDM4EHSD17B10HPGDALDH1A1
SCHEMBL820869 0.82 ELANE (0.57) ELANEKDM4EHSD17B10HPGDALDH1A1
SCHEMBL9772059 0.81 KDM4E (0.68) ELANEKDM4EHSD17B10HPGDALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1846519-A1 A PIGMENT DISPERSION COMPRISING A COPOLYMER COMPRISING AN IONIC AROMATIC MONOMER Agfa Graphics N.V. (BE) 2007-10-24 EP disclosed
WO-2006082160-A1 A PIGMENT DISPERSION COMPRISING A COPOLYMER COMPRISING AN IONIC AROMATIC MONOMER AGFA GRAPHICS NV (BE) 2006-08-10 WO disclosed