SCHEMBL10823443

SCHEMBL10823443

Cc1cc(S(=O)(=O)Nc2cc3cc(O)ccc3cc2S(=O)(=O)O)ccc1NC(=O)Nc1ccc(S(=O)(=O)Nc2cc3cc(O)ccc3cc2S(=O)(=O)O)cc1C

nearest known ligand 0.44

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 4/20 0.44
▸ KMT2A Q03164 4/20 0.44
▸ PTGES O14684 1/20 0.41
▸ CYTH2 Q99418 3/20 0.40
▸ CA12 O43570 2/20 0.39
▸ CA1 P00915 2/20 0.39
▸ CA2 P00918 2/20 0.39
▸ CA9 Q16790 2/20 0.39
▸ GFER P55789 2/20 0.38
▸ IDH1 O75874 1/20 0.38
▸ ALDH1A1 P00352 2/20 0.38
▸ POLB P06746 2/20 0.38
▸ MAPT P10636 1/20 0.38
▸ BLM P54132 1/20 0.38
▸ GAA P10253 1/20 0.38
▸ TIMP3 P35625 1/20 0.37
▸ LMNA P02545 1/20 0.36
▸ FFAR4 Q5NUL3 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
SCHEMBL10823568 0.84 LMNA (0.44) CA2GFERPOLBGAATIMP3
SCHEMBL10823472 0.83 PTGES (0.46) MEN1KMT2APTGESCYTH2CA12
SCHEMBL10823661 0.82 MEN1 (0.43) MEN1KMT2ACA12CA1CA2
SCHEMBL10823553 0.82 PTGES (0.50) MEN1KMT2APTGESCA12CA1
SCHEMBL10823376 0.82 PKM (0.46) MEN1KMT2ACA12CA1CA2
SCHEMBL10823575 0.81 MEN1 (0.48) MEN1KMT2ACA12CA1CA2
SCHEMBL10823352 0.81 PTGES (0.41) MEN1KMT2APTGESCYTH2CA12
SCHEMBL11342247 0.81 MAPT (0.46) MEN1KMT2AALDH1A1POLBMAPT
SCHEMBL10823660 0.80 IDH1 (0.53) IDH1
SCHEMBL10823744 0.80 PRMT1 (0.44) MEN1KMT2APTGESCYTH2CA12

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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