SCHEMBL10823609

SCHEMBL10823609

O=C(Nc1ccc(S(=O)(=O)Nc2cc(O)c3ccc(S(=O)(=O)O)cc3c2)cc1)Nc1ccc(S(=O)(=O)Nc2cc(O)c3ccc(S(=O)(=O)O)cc3c2)cc1

nearest known ligand 0.73

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ PRMT1 Q99873 2/20 0.73
▸ SIRT1 Q96EB6 1/20 0.62
▸ CASP6 P55212 2/20 0.52
▸ CTDSP1 Q9GZU7 1/20 0.52
▸ NT5E P21589 1/20 0.48
▸ NSD2 O96028 1/20 0.48
▸ DUSP3 P51452 1/20 0.48
▸ PTPN5 P54829 1/20 0.48
▸ PTPN11 Q06124 1/20 0.48
▸ LMNA P02545 2/20 0.46
▸ TIMP3 P35625 1/20 0.46
▸ KMT2A Q03164 2/20 0.45
▸ MEN1 O00255 1/20 0.45
▸ ALDH1A1 P00352 1/20 0.45
▸ ALOX12 P18054 1/20 0.45
▸ ENPP2 Q13822 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
SCHEMBL10823628 0.95 PRMT1 (0.78) PRMT1SIRT1CASP6CTDSP1NT5E
SCHEMBL10823632 0.91 PRMT1 (0.60) PRMT1SIRT1CASP6NT5ENSD2
SCHEMBL10823345 0.88 PRMT1 (0.67) PRMT1SIRT1CASP6CTDSP1NT5E
SCHEMBL10823488 0.86 PRMT1 (0.64) PRMT1SIRT1CASP6NT5ENSD2
SCHEMBL10823606 0.85 PRMT1 (0.66) PRMT1SIRT1
SCHEMBL29349608 0.85 PRMT1 (1.00) PRMT1SIRT1CASP6CTDSP1NT5E
SCHEMBL6079067 0.85 PRMT1 (1.00) PRMT1SIRT1CASP6CTDSP1NT5E
SCHEMBL2679101 0.85 PRMT1 (1.00) PRMT1SIRT1CASP6CTDSP1NT5E
SCHEMBL6079153 0.84 PRMT1 (0.72) PRMT1SIRT1CASP6CTDSP1NT5E
SCHEMBL6078726 0.84 PRMT1 (0.72) PRMT1SIRT1CASP6CTDSP1NT5E

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-H83-H Dental antiplaque agents and inhibitors of connective tissue destruction AMERICAN CYANAMID COMPANY (US) 1986-07-01 — — US disclosed
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