SCHEMBL10823472

SCHEMBL10823472

Cc1cc(S(=O)(=O)Nc2cc(S(=O)(=O)O)cc3ccc(O)cc23)ccc1NC(=O)Nc1ccc(S(=O)(=O)Nc2cc(S(=O)(=O)O)cc3ccc(O)cc23)cc1C

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PTGES O14684 1/20 0.46
▸ MEN1 O00255 4/20 0.44
▸ KMT2A Q03164 4/20 0.44
▸ TRPV1 Q8NER1 4/20 0.40
▸ POLB P06746 3/20 0.40
▸ ALDH1A1 P00352 2/20 0.40
▸ MAPT P10636 2/20 0.40
▸ BLM P54132 1/20 0.40
▸ CYTH2 Q99418 1/20 0.40
▸ PRMT1 Q99873 1/20 0.39
▸ CA12 O43570 1/20 0.39
▸ CA1 P00915 1/20 0.39
▸ CA2 P00918 1/20 0.39
▸ CA9 Q16790 1/20 0.39
▸ GFER P55789 1/20 0.38
▸ LMNA P02545 2/20 0.38
▸ HSP90AA1 P07900 1/20 0.38
▸ GAA P10253 1/20 0.38
▸ MAPK1 P28482 1/20 0.38
▸ SMN1; SMN2 Q16637 1/20 0.38

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
SCHEMBL10823744 0.91 PRMT1 (0.44) PTGESMEN1KMT2APOLBALDH1A1
SCHEMBL10823553 0.86 PTGES (0.50) PTGESMEN1KMT2ATRPV1ALDH1A1
SCHEMBL10823437 0.84 CASP6 (0.44) MEN1KMT2APOLBALDH1A1MAPT
SCHEMBL10823390 0.83 HKDC1 (0.46) PTGESMEN1KMT2APRMT1CA12
SCHEMBL10823352 0.83 PTGES (0.41) PTGESMEN1KMT2AALDH1A1CYTH2
SCHEMBL10823506 0.83 PRMT1 (0.45) MEN1KMT2APOLBALDH1A1MAPT
SCHEMBL10823443 0.83 MEN1 (0.44) PTGESMEN1KMT2APOLBALDH1A1
SCHEMBL11339174 0.83 HPSE (0.46) MEN1KMT2ATRPV1ALDH1A1MAPT
SCHEMBL10823596 0.81 TRPV1 (0.51) MEN1KMT2ATRPV1MAPTPRMT1
SCHEMBL10823686 0.81 IDH1 (0.52) PTGESPRMT1

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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