SCHEMBL8092427

SCHEMBL8092427

O=C(O)Cc1ccccc1OC(=O)c1ccccc1O

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 3/20 0.64
HPGD P15428 2/20 0.64
ALDH1A1 P00352 2/20 0.64
KDM4E B2RXH2 2/20 0.64
AKR1B1 P15121 1/20 0.58
ALOX15 P16050 1/20 0.56
CXCL8 P10145 2/20 0.49
ATM Q13315 1/20 0.48
KMT2A Q03164 3/20 0.48
POLB P06746 1/20 0.48
GAA P10253 1/20 0.48
TDP1 Q9NUW8 2/20 0.47
LMNA P02545 2/20 0.46
TSHR P16473 1/20 0.46
ESR1 P03372 3/20 0.44
ESR2 Q92731 3/20 0.44
HTT P42858 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
MEN1 O00255 1/20 0.44
CHRM1 P11229 1/20 0.43

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
SCHEMBL9333909 0.84 HSD17B10 (0.63) HSD17B10HPGDALDH1A1KDM4EALOX15
SCHEMBL16674880 0.84 HSD17B10 (0.63) HSD17B10HPGDALDH1A1KDM4EALOX15
SCHEMBL9650824 0.84 HSD17B10 (0.55) HSD17B10HPGDALDH1A1KDM4EALOX15
SCHEMBL27890099 0.83 HSD17B10 (0.61) HSD17B10HPGDALDH1A1KDM4EALOX15
SCHEMBL15529211 0.82 HPGD (0.69) HSD17B10HPGDALDH1A1KDM4EALOX15
Bicarbonate SCHEMBL27678150 0.81 HSD17B10 (0.59) HSD17B10HPGDALDH1A1KDM4EALOX15
SCHEMBL11847525 0.80 MAPT (0.58) HSD17B10AKR1B1ALOX15CXCL8KMT2A
SCHEMBL31112176 0.80 MAPT (0.58) HSD17B10AKR1B1ALOX15CXCL8KMT2A
SCHEMBL3635482 0.79 HPGD (0.76) HSD17B10HPGDALDH1A1KDM4EALOX15
SCHEMBL2052137 0.79 KDM4E (0.56) HSD17B10HPGDALDH1A1KDM4EALOX15

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-1051549-A1 TREATMENT OF FABRICS IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 2000-11-15 EP claimed
WO-1999039039-A1 TREATMENT OF FABRICS IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1999-08-05 WO claimed