SCHEMBL10823516

SCHEMBL10823516

Cc1cc(S(=O)(=O)Nc2cccc3cc(O)cc(S(=O)(=O)O)c23)ccc1NC(=O)Nc1ccc(S(=O)(=O)Nc2cccc3cc(O)cc(S(=O)(=O)O)c23)cc1C

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 3/20 0.42
▸ KMT2A Q03164 3/20 0.42
▸ CA12 O43570 1/20 0.40
▸ CA1 P00915 1/20 0.40
▸ CA2 P00918 1/20 0.40
▸ CA9 Q16790 1/20 0.40
▸ HPSE Q9Y251 1/20 0.39
▸ POLB P06746 3/20 0.39
▸ CASP6 P55212 1/20 0.39
▸ HTT P42858 1/20 0.39
▸ ALDH1A1 P00352 3/20 0.39
▸ MAPT P10636 1/20 0.39
▸ BLM P54132 1/20 0.39
▸ LMNA P02545 2/20 0.39
▸ HSD17B10 Q99714 1/20 0.39
▸ UQCRB P14927 1/20 0.38
▸ IDH2 P48735 1/20 0.38
▸ TSHR P16473 1/20 0.38
▸ GHSR Q92847 1/20 0.38
▸ GAA P10253 1/20 0.37

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
SCHEMBL10823595 0.85 UQCRB (0.41) MEN1KMT2ACA12CA1CA2
SCHEMBL10823759 0.85 MEN1 (0.46) MEN1KMT2APOLBHTTALDH1A1
SCHEMBL10823454 0.84 CA12 (0.41) MEN1KMT2ACA12CA1CA2
SCHEMBL10823439 0.84 APEX1 (0.45) MEN1KMT2ACA12CA1CA2
SCHEMBL10823747 0.84 MAPT (0.51) MEN1KMT2ACA12CA1CA2
SCHEMBL11344815 0.82 MEN1 (0.49) MEN1KMT2AHPSEPOLBALDH1A1
SCHEMBL10823534 0.81 CA12 (0.45) MEN1KMT2ACA12CA1CA2
SCHEMBL10823477 0.81 CA12 (0.45) MEN1KMT2ACA12CA1CA2
SCHEMBL10823624 0.81 IDH1 (0.53) IDH2
SCHEMBL10823417 0.80 EP300 (0.46) MEN1KMT2ACA12CA1CA2

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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