SCHEMBL10823595

SCHEMBL10823595

Cc1cc(S(=O)(=O)Nc2cccc3ccc(S(=O)(=O)O)c(O)c23)ccc1NC(=O)Nc1ccc(S(=O)(=O)Nc2cccc3ccc(S(=O)(=O)O)c(O)c23)cc1C

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ UQCRB P14927 1/20 0.41
▸ CA12 O43570 1/20 0.40
▸ CA1 P00915 1/20 0.40
▸ CA2 P00918 1/20 0.40
▸ CA9 Q16790 1/20 0.40
▸ MEN1 O00255 3/20 0.40
▸ KMT2A Q03164 3/20 0.40
▸ HPSE Q9Y251 1/20 0.39
▸ POLB P06746 2/20 0.39
▸ CASP6 P55212 1/20 0.39
▸ HTT P42858 1/20 0.39
▸ ALDH1A1 P00352 2/20 0.39
▸ MAPT P10636 1/20 0.39
▸ BLM P54132 1/20 0.39
▸ HSD17B10 Q99714 1/20 0.39
▸ LMNA P02545 1/20 0.39
▸ IDH2 P48735 1/20 0.38
▸ TSHR P16473 1/20 0.38
▸ HSD17B2 P37059 1/20 0.38
▸ GHSR Q92847 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
SCHEMBL10823499 0.85 KMT2A (0.42) UQCRBCA12CA1CA2CA9
SCHEMBL10823516 0.85 MEN1 (0.42) UQCRBCA12CA1CA2CA9
SCHEMBL10823370 0.84 EP300 (0.43) CA12CA1CA2CA9MEN1
SCHEMBL10823419 0.84 MAPT (0.51) CA12CA1CA2CA9MEN1
SCHEMBL10823418 0.84 UQCRB (0.47) UQCRBCA2MEN1KMT2APOLB
SCHEMBL10823534 0.83 CA12 (0.45) CA12CA1CA2CA9MEN1
SCHEMBL10823401 0.83 CA12 (0.42) CA12CA1CA2CA9MEN1
SCHEMBL10823477 0.83 CA12 (0.45) UQCRBCA12CA1CA2CA9
SCHEMBL11341062 0.82 KMT2A (0.49) MEN1KMT2AHPSEPOLBALDH1A1
SCHEMBL10823448 0.82 HPSE (0.44) UQCRBCA12CA1CA2CA9

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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