SCHEMBL11846815

SCHEMBL11846815

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

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ THRB P10828 2/20 0.44
▸ LMNA P02545 3/20 0.44
▸ POLB P06746 2/20 0.44
▸ MEN1 O00255 1/20 0.44
▸ KMT2A Q03164 1/20 0.44
▸ ALKBH2 Q6NS38 1/20 0.43
▸ ALKBH5 Q6P6C2 1/20 0.43
▸ ALKBH3 Q96Q83 1/20 0.43
▸ FTO Q9C0B1 1/20 0.43
▸ TPMT P51580 1/20 0.43
▸ HPSE Q9Y251 1/20 0.42
▸ ALDH1A1 P00352 4/20 0.42
▸ HPGD P15428 3/20 0.42
▸ KDM4E B2RXH2 3/20 0.42
▸ NPSR1 Q6W5P4 2/20 0.42
▸ USP2 O75604 2/20 0.42
▸ HIF1A Q16665 2/20 0.42
▸ HSD17B10 Q99714 2/20 0.42
▸ CA2 P00918 2/20 0.42
▸ GAA P10253 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
SCHEMBL11799395 0.89 LMNA (0.59) LMNAPOLBMEN1KMT2AALDH1A1
SCHEMBL11846152 0.89 HPSE (0.46) THRBLMNAPOLBMEN1KMT2A
SCHEMBL30241210 0.87 ALDH1A1 (0.44) THRBLMNAPOLBMEN1KMT2A
SCHEMBL28945995 0.87 ALDH1A1 (0.44) THRBLMNAPOLBMEN1KMT2A
SCHEMBL11846360 0.86 PKM (0.60) THRBLMNAPOLBMEN1KMT2A
SCHEMBL14879785 0.85 VCAM1 (0.51) THRBLMNAPOLBMEN1KMT2A
SCHEMBL573640 0.82 KDM4E (0.58) LMNAPOLBMEN1KMT2ATPMT
SCHEMBL11843602 0.82 ALDH1A1 (0.55) LMNATPMTALDH1A1HPGDKDM4E
SCHEMBL11850832 0.82 TPMT (0.45) THRBLMNAPOLBMEN1KMT2A
SCHEMBL11847444 0.81 ALDH1A1 (0.47) LMNAALDH1A1HPGDKDM4ENPSR1

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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