SCHEMBL11851183

SCHEMBL11851183

CCOC(=O)c1cc(NCc2ccccc2)c(Oc2ccc(OCc3ccccc3)cc2)c(S(N)(=O)=O)c1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CA2 P00918 3/20 0.53
▸ HPGD P15428 3/20 0.53
▸ LMNA P02545 3/20 0.53
▸ KDM4E B2RXH2 2/20 0.53
▸ ALDH1A1 P00352 2/20 0.53
▸ USP2 O75604 1/20 0.53
▸ TSHR P16473 1/20 0.53
▸ BLM P54132 1/20 0.53
▸ SLC12A2 P55011 1/20 0.53
▸ HIF1A Q16665 1/20 0.53
▸ NPSR1 Q6W5P4 1/20 0.53
▸ HSD17B10 Q99714 1/20 0.53
▸ PTGS2 P35354 3/20 0.47
▸ AQP1 P29972 1/20 0.46
▸ CA12 O43570 2/20 0.45
▸ CA1 P00915 2/20 0.45
▸ CA9 Q16790 2/20 0.45
▸ PTGES2 Q9H7Z7 1/20 0.45
▸ ALOX15 P16050 1/20 0.44
▸ PPARG P37231 1/20 0.43

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
SCHEMBL11840282 0.91 ALDH1A1 (0.55) CA2HPGDLMNAKDM4EALDH1A1
SCHEMBL11842331 0.89 CA2 (0.61) CA2HPGDLMNAKDM4EALDH1A1
SCHEMBL11851117 0.83 LMNA (0.64) CA2HPGDLMNAKDM4EALDH1A1
SCHEMBL11846114 0.83 KDM4E (0.51) CA2HPGDLMNAKDM4EALDH1A1
SCHEMBL11847754 0.82 ALDH1A1 (0.48) CA2HPGDLMNAKDM4EALDH1A1
SCHEMBL11849933 0.82 ALDH1A1 (0.71) CA2HPGDLMNAKDM4EALDH1A1
SCHEMBL11843695 0.81 ALOX15 (0.45) CA2HPGDLMNAKDM4EALDH1A1
SCHEMBL11849266 0.81 ALDH1A1 (0.47) CA2HPGDLMNAKDM4EALDH1A1
SCHEMBL21436443 0.81 CA2 (0.54) CA2HPGDLMNAKDM4EALDH1A1
SCHEMBL10829293 0.81 KDM4E (0.67) CA2HPGDLMNAKDM4EALDH1A1

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-3985777-A Sulphamyl-benzoic acid derivatives LOVENS KEMISKE FABRIK PRODUKTIONSAKTIESELSKAB (DK) 1976-10-12 — — US disclosed
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