SCHEMBL11843602

SCHEMBL11843602

CCCCNS(=O)(=O)c1cc(C(=O)O)cc([N+](=O)[O-])c1Oc1ccccc1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 2/20 0.55
▸ KDM4E B2RXH2 1/20 0.55
▸ USP2 O75604 1/20 0.55
▸ CA2 P00918 1/20 0.55
▸ LMNA P02545 1/20 0.55
▸ HPGD P15428 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
▸ GAA P10253 1/20 0.50
▸ MAPT P10636 1/20 0.50
▸ CA12 O43570 3/20 0.48
▸ CA9 Q16790 3/20 0.48
▸ HCAR3 P49019 3/20 0.47
▸ NPY5R Q15761 1/20 0.44
▸ AQP1 P29972 1/20 0.41
▸ PTGS2 P35354 2/20 0.40

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
SCHEMBL11842215 0.91 KDM4E (0.47) ALDH1A1KDM4EUSP2CA2LMNA
SCHEMBL11842219 0.91 KDM4E (0.47) ALDH1A1KDM4EUSP2CA2LMNA
SCHEMBL30241210 0.84 ALDH1A1 (0.44) ALDH1A1KDM4EUSP2CA2LMNA
SCHEMBL28945995 0.84 ALDH1A1 (0.44) ALDH1A1KDM4EUSP2CA2LMNA
SCHEMBL11846152 0.84 HPSE (0.46) ALDH1A1KDM4EUSP2CA2LMNA
SCHEMBL11847715 0.83 ALDH1A1 (0.61) ALDH1A1KDM4EUSP2CA2LMNA
SCHEMBL11845554 0.82 KDM4E (0.79) ALDH1A1KDM4EUSP2CA2LMNA
SCHEMBL11846815 0.82 THRB (0.44) ALDH1A1KDM4EUSP2CA2LMNA
SCHEMBL11787827 0.81 KDM4E (0.76) ALDH1A1KDM4EUSP2CA2LMNA
SCHEMBL14879785 0.81 VCAM1 (0.51) ALDH1A1KDM4EUSP2CA2LMNA

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
Send feedback