SCHEMBL9750105

SCHEMBL9750105

O=C(Oc1cccc2ccccc12)c1ccc(O)c(O)c1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 2/20 0.59
PTGES O14684 1/20 0.57
ESR1 P03372 6/20 0.55
ESR2 Q92731 6/20 0.55
KMT2A Q03164 5/20 0.55
GAA P10253 3/20 0.55
HSD17B10 Q99714 3/20 0.55
MEN1 O00255 3/20 0.55
MAPT P10636 2/20 0.55
JAK2 O60674 1/20 0.55
USP2 O75604 1/20 0.55
ALOX15 P16050 1/20 0.55
SMN1; SMN2 Q16637 1/20 0.55
NPSR1 Q6W5P4 1/20 0.55
POLB P06746 2/20 0.54
SERPINE1 P05121 1/20 0.53
HTT P42858 1/20 0.49
MMP2 P08253 1/20 0.49
ALDH1A1 P00352 1/20 0.49
PGR P06401 1/20 0.49

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
SCHEMBL8756031 0.89 ESR1 (0.50) ALOX5PTGESESR1ESR2KMT2A
SCHEMBL3005634 0.87 ESR1 (0.57) ALOX5ESR1ESR2KMT2AGAA
SCHEMBL8756335 0.86 SERPINE1 (0.50) ALOX5PTGESESR1ESR2KMT2A
SCHEMBL27542441 0.86 GCGR (0.58) ALOX5PTGESESR1ESR2KMT2A
SCHEMBL29613809 0.85 ALOX5 (0.71) ALOX5PTGESESR1ESR2KMT2A
SCHEMBL5081762 0.85 ALOX5 (0.71) ALOX5PTGESESR1ESR2KMT2A
SCHEMBL1043660 0.85 ALOX5 (0.63) ALOX5PTGESESR1ESR2KMT2A
SCHEMBL13286773 0.85 SERPINE1 (0.70) ESR1ESR2KMT2AGAAHSD17B10
SCHEMBL8648321 0.84 ALOX5 (0.62) ALOX5PTGESESR1ESR2KMT2A
SCHEMBL4596186 0.84 ALOX5 (0.62) ALOX5PTGESESR1ESR2KMT2A

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
US-5084593-A Cyanine, aniline dyes for heat sensitive recording elements RICOH COMPANY, LTD. (JP) 1992-01-28 US disclosed
US-5008238-A Thermosensitive material with phenolic developer RICOH COMPANY, LTD. (JP) 1991-04-16 US disclosed