SCHEMBL10849385

SCHEMBL10849385

COc1cc(OC)c(C=C2Nc3ccc(S(=O)(=O)O)cc3C2=O)cc1C=C1Nc2ccc(S(=O)(=O)O)cc2C1=O

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TYR P14679 2/20 0.40
▸ MAPT P10636 3/20 0.39
▸ APP P05067 2/20 0.39
▸ CASP3 P42574 3/20 0.38
▸ POLB P06746 2/20 0.36
▸ NCOA1 Q15788 1/20 0.36
▸ NCOA3 Q9Y6Q9 1/20 0.36
▸ MDM2 Q00987 2/20 0.36
▸ CA12 O43570 1/20 0.36
▸ CA1 P00915 1/20 0.36
▸ CA2 P00918 1/20 0.36
▸ CA9 Q16790 1/20 0.36
▸ ALDH1A1 P00352 1/20 0.36
▸ PSEN1 P49768 1/20 0.36
▸ PSEN2 P49810 1/20 0.36
▸ APH1B Q8WW43 1/20 0.36
▸ NCSTN Q92542 1/20 0.36
▸ APH1A Q96BI3 1/20 0.36
▸ PSENEN Q9NZ42 1/20 0.36
▸ MEN1 O00255 2/20 0.35

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
SCHEMBL10845785 0.96 TYR (0.40) TYRMAPTAPPCASP3POLB
SCHEMBL10849192 0.79 TYR (0.56) TYRMAPTPOLBNCOA1NCOA3
SCHEMBL10845595 0.79 MAPT (0.51) TYRMAPTAPPCASP3CA12
SCHEMBL10845588 0.79 MAPT (0.51) TYRMAPTAPPCASP3CA12
SCHEMBL10852100 0.79 TYR (0.49) TYRMAPTAPPCASP3CA12
SCHEMBL10852779 0.76 MAPT (0.50) TYRMAPTAPPCASP3CA12
SCHEMBL10852784 0.76 MAPT (0.50) TYRMAPTAPPCASP3CA12
SCHEMBL10848654 0.75 TYR (0.57) TYRMAPTPOLBNCOA1NCOA3
SCHEMBL10849419 0.74 MAPT (0.51) TYRMAPTAPPCASP3POLB
SCHEMBL10848662 0.74 MAPT (0.44) TYRMAPTAPPCASP3CA12

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4567048-A SULFONATED INDOXYL DERIVATIVES PFIZER INC. (US) 1986-01-28 — — US disclosed
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