SCHEMBL9650827

SCHEMBL9650827

C=C(C)C(=O)c1ccccc1OC(=O)c1ccccc1O

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 5/20 0.64
HPGD P15428 4/20 0.64
KDM4E B2RXH2 3/20 0.64
ALDH1A1 P00352 3/20 0.64
ALOX15 P16050 1/20 0.51
LMNA P02545 2/20 0.50
TSHR P16473 2/20 0.50
CYP1A2 P05177 1/20 0.50
CYP2C9 P11712 1/20 0.50
KMT2A Q03164 6/20 0.48
ESR1 P03372 4/20 0.48
ESR2 Q92731 3/20 0.48
MEN1 O00255 1/20 0.48
POLB P06746 1/20 0.48
GAA P10253 1/20 0.48
HTT P42858 2/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
TDP1 Q9NUW8 3/20 0.44
PTGS2 P35354 2/20 0.44
ITGB3 P05106 1/20 0.44

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
SCHEMBL7038760 0.85 HSD17B10 (0.74) HSD17B10HPGDKDM4EALDH1A1ALOX15
SCHEMBL12608927 0.83 HSD17B10 (0.72) HSD17B10HPGDKDM4EALDH1A1ALOX15
SCHEMBL14136216 0.82 HSD17B10 (0.75) HSD17B10HPGDKDM4EALDH1A1ALOX15
SCHEMBL13829204 0.82 HSD17B10 (0.70) HSD17B10HPGDKDM4EALDH1A1ALOX15
SCHEMBL19754918 0.81 HSD17B10 (0.64) HSD17B10HPGDKDM4EALDH1A1ALOX15
SCHEMBL5852958 0.81 KDM4E (0.52) HSD17B10HPGDKDM4EALDH1A1ALOX15
SCHEMBL31107414 0.81 KDM4E (0.52) HSD17B10HPGDKDM4EALDH1A1ALOX15
SCHEMBL16577182 0.80 HSD17B10 (0.62) HSD17B10HPGDKDM4EALDH1A1ALOX15
SCHEMBL17208126 0.80 HSD17B10 (0.62) HSD17B10HPGDKDM4EALDH1A1ALOX15
SCHEMBL3635482 0.79 HPGD (0.76) HSD17B10HPGDKDM4EALDH1A1ALOX15

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-0515401-A1 ENDLESS OBJECTS FROM ACRYLATES DSM N.V. (NL) 1992-12-02 EP disclosed
WO-1991011489-A1 ENDLESS OBJECTS FROM ACRYLATES DSM N.V. (NL) 1991-08-08 WO disclosed