SCHEMBL6928302

SCHEMBL6928302

O=P(Oc1ccc(O)cc1Cl)(Oc1ccc(O)cc1Cl)Oc1ccc(O)cc1Cl

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 1/20 0.46
TTR P02766 3/20 0.41
ESR1 P03372 5/20 0.38
CA12 O43570 1/20 0.38
CA1 P00915 1/20 0.38
CA2 P00918 1/20 0.38
CA7 P43166 1/20 0.38
CA9 Q16790 1/20 0.38
CA14 Q9ULX7 1/20 0.38
ESR2 Q92731 3/20 0.37
LMNA P02545 2/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
NR1I2 O75469 1/20 0.36
PGR P06401 1/20 0.36
HSP90AA1 P07900 1/20 0.36
ADORA3 P0DMS8 1/20 0.36
MAPT P10636 1/20 0.36
HSPA5 P11021 1/20 0.36
HPGD P15428 1/20 0.36
CBR1 P16152 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
SCHEMBL6928304 0.86 INPPL1 (0.50) HSD17B10TTRHPGD
SCHEMBL5705512 0.85 HSD17B10 (0.43) HSD17B10TTRESR1CA12CA1
SCHEMBL4372626 0.79 TDP1 (0.51) TTRLMNASMN1; SMN2NR1I2PGR
SCHEMBL29892533 0.79 TDP1 (0.51) TTRLMNASMN1; SMN2NR1I2PGR
SCHEMBL9623596 0.76 TTR (0.57) HSD17B10TTRESR1CA12CA1
SCHEMBL7161426 0.76 NPC1 (0.42) LMNASMN1; SMN2HPGDSLC6A2SLC6A3
SCHEMBL9621944 0.76 SRC (0.40) LMNA
SCHEMBL28246273 0.74 HSD17B10 (0.54) HSD17B10TTRESR1CA12CA1
SCHEMBL6913382 0.74 HSD17B10 (0.54) HSD17B10TTRESR1CA12CA1
SCHEMBL2096187 0.72 MAOB (0.56) HSD17B10TTRSMN1; SMN2MAPTHPGD

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
EP-1054933-A4 CHEMILUMINESCENT REACTIONS USING DIHYDROXYAROMATIC COMPOUNDS AND HETEROCYCLIC ENOL PHOSPHATES LUMIGEN INC (US) 2003-07-09 EP claimed
EP-1054933-A1 CHEMILUMINESCENT REACTIONS USING DIHYDROXYAROMATIC COMPOUNDS AND HETEROCYCLIC ENOL PHOSPHATES LUMIGEN, INC. (US) 2000-11-29 EP claimed
WO-1999040161-A1 CHEMILUMINESCENT REACTIONS USING DIHYDROXYAROMATIC COMPOUNDS AND HETEROCYCLIC ENOL PHOSPHATES LUMIGEN, INC. (US) 1999-08-12 WO claimed
US-5840963-A HALOGEN-SUBSTITUTED HYDROQUINONES HAVING ONE HYDROXY GROUP PROTECTED BY PHOSPHATE GROUP LUMIGEN, INC. (US) 1998-11-24 US claimed