SCHEMBL964273

SCHEMBL964273

O=C(O)c1ccc2ccccc2c1C(=O)O.[Na]

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
WDR5 P61964 1/20 0.66
LDHA P00338 1/20 0.63
ALDH1A1 P00352 5/20 0.59
HPGD P15428 4/20 0.59
KDM4E B2RXH2 3/20 0.59
GLA P06280 2/20 0.59
NR4A1 P22736 1/20 0.59
NR4A2 P43354 1/20 0.59
NR4A3 Q92570 1/20 0.59
MEN1 O00255 1/20 0.59
CYP1A2 P05177 1/20 0.59
CYP2C19 P33261 1/20 0.59
KMT2A Q03164 1/20 0.59
HSD17B10 Q99714 1/20 0.59
CDC25B P30305 2/20 0.56
METAP2 P50579 2/20 0.53
METAP1 P53582 1/20 0.53
LMNA P02545 1/20 0.47
CSNK2A2 P19784 1/20 0.47
CSNK2B P67870 1/20 0.47

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
SCHEMBL4577224 1.00 WDR5 (0.66) WDR5LDHAALDH1A1HPGDKDM4E
SCHEMBL31070983 1.00 WDR5 (0.66) WDR5LDHAALDH1A1HPGDKDM4E
SCHEMBL27804512 0.98 WDR5 (0.68) WDR5LDHAALDH1A1HPGDKDM4E
Benzene SCHEMBL27549874 0.98 WDR5 (0.68) WDR5LDHAALDH1A1HPGDKDM4E
SCHEMBL29376013 0.98 WDR5 (0.68) WDR5LDHAALDH1A1HPGDKDM4E
SCHEMBL33850 0.98 WDR5 (0.68) WDR5LDHAALDH1A1HPGDKDM4E
Naphthalene SCHEMBL1831655 0.96 WDR5 (0.66) WDR5LDHAALDH1A1HPGDKDM4E
Potassium SCHEMBL9788816 0.96 WDR5 (0.66) WDR5LDHAALDH1A1HPGDKDM4E
Ammonia Solution, Strong SCHEMBL8803959 0.96 WDR5 (0.66) WDR5LDHAALDH1A1HPGDKDM4E
SCHEMBL19307798 0.96 WDR5 (0.66) WDR5LDHAALDH1A1HPGDKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110021697-A1 METHODS FOR PREPARING POLYETHER ESTER ELASTOMER COMPOSITION E. I. DU PONT DE NEMOURS AND COMPANY (US) 2011-01-27 US disclosed
WO-2008054777-A2 POLYETHER ESTER ELASTOMER COMPOSITION E. I. DU PONT DE NEMOURS AND COMPANY (US) 2008-05-08 WO disclosed
US-20080103217-A1 Polyether ester elastomer composition E. I. DU PONT DE NEMOURS AND COMPANY 2008-05-01 US disclosed