SCHEMBL11840282

SCHEMBL11840282

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

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 4/20 0.55
▸ KDM4E B2RXH2 3/20 0.55
▸ LMNA P02545 3/20 0.55
▸ HPGD P15428 3/20 0.55
▸ CA2 P00918 2/20 0.55
▸ USP2 O75604 1/20 0.55
▸ TSHR P16473 1/20 0.55
▸ BLM P54132 1/20 0.55
▸ SLC12A2 P55011 1/20 0.55
▸ HIF1A Q16665 1/20 0.55
▸ NPSR1 Q6W5P4 1/20 0.55
▸ HSD17B10 Q99714 1/20 0.55
▸ PTGS2 P35354 7/20 0.48
▸ AQP1 P29972 1/20 0.47
▸ ALOX15 P16050 1/20 0.45
▸ SMN1; SMN2 Q16637 3/20 0.44
▸ MAPT P10636 1/20 0.44
▸ TDP1 Q9NUW8 1/20 0.44
▸ HDAC8 Q9BY41 2/20 0.42
▸ HDAC1 Q13547 1/20 0.42

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
SCHEMBL11851183 0.91 CA2 (0.53) ALDH1A1KDM4ELMNAHPGDCA2
SCHEMBL11849479 0.89 CA2 (0.65) ALDH1A1KDM4ELMNAHPGDCA2
SCHEMBL11843685 0.85 MAPT (0.44) ALDH1A1KDM4ELMNAHPGDCA2
SCHEMBL11851117 0.85 LMNA (0.64) ALDH1A1KDM4ELMNAHPGDCA2
SCHEMBL11846114 0.85 KDM4E (0.51) ALDH1A1KDM4ELMNAHPGDCA2
SCHEMBL21436443 0.85 CA2 (0.54) ALDH1A1KDM4ELMNAHPGDCA2
SCHEMBL11847754 0.83 ALDH1A1 (0.48) ALDH1A1KDM4ELMNAHPGDCA2
SCHEMBL11849933 0.83 ALDH1A1 (0.71) ALDH1A1KDM4ELMNAHPGDCA2
SCHEMBL11849266 0.83 ALDH1A1 (0.47) ALDH1A1KDM4ELMNAHPGDCA2
SCHEMBL10829293 0.82 KDM4E (0.67) ALDH1A1KDM4ELMNAHPGDCA2

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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