SCHEMBL7076183

SCHEMBL7076183

COC(=O)c1ccccc1S(=O)(=O)N1CCc2ccccc2C1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.58
L3MBTL1 Q9Y468 2/20 0.58
FNTA P49354 2/20 0.55
FNTB P49356 2/20 0.55
LMNA P02545 1/20 0.53
MEN1 O00255 3/20 0.52
ALDH1A1 P00352 2/20 0.52
POLB P06746 1/20 0.52
AKR1C3 P42330 2/20 0.51
CYP3A4 P08684 1/20 0.51
CYP2C19 P33261 1/20 0.51
SMN1; SMN2 Q16637 1/20 0.51
NPSR1 Q6W5P4 1/20 0.51
CA1 P00915 1/20 0.50
CA2 P00918 1/20 0.50
CA5A P35218 1/20 0.50
CA9 Q16790 1/20 0.50
PRMT5 O14744 1/20 0.50
WDR77 Q9BQA1 1/20 0.50
TSHR P16473 1/20 0.50

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
SCHEMBL7077474 0.84 KMT2A (0.63) KMT2AL3MBTL1LMNAMEN1ALDH1A1
SCHEMBL3061701 0.83 PKM (0.52) KMT2AL3MBTL1FNTAFNTBMEN1
SCHEMBL7076468 0.83 KMT2A (0.59) KMT2AL3MBTL1LMNAMEN1ALDH1A1
SCHEMBL3049341 0.81 CA1 (0.51) KMT2AL3MBTL1FNTAFNTBLMNA
SCHEMBL8337431 0.81 CA1 (0.58) KMT2AL3MBTL1LMNAMEN1ALDH1A1
SCHEMBL3061681 0.78 CYP19A1 (0.57) KMT2AL3MBTL1LMNAALDH1A1POLB
SCHEMBL14697013 0.77 HSD17B10 (0.56) LMNAALDH1A1POLBCA1CA2
SCHEMBL14477864 0.76 POLB (0.53) KMT2AL3MBTL1FNTAFNTBLMNA
SCHEMBL17993697 0.75 TSHR (0.54) KMT2AFNTAFNTBLMNAALDH1A1
SCHEMBL20435712 0.74 TP53 (0.54) KMT2AL3MBTL1LMNAMEN1ALDH1A1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20030022893-A1 Hydroxamic and carboxylic acid derivatives BAXTER ANDREW DOUGLAS (GB) 2003-01-30 US disclosed
US-6465468-B1 SUCH AS N-HYDROXY-2-(4-(4-CHLOROPHENYL)PIPERAZINE-1-SULFONYL)BENZAMIDE; INHIBITORS OF MATRIX METALLOPROTEINASE, ADAM OR ADAMTS ENZYMES; TREATMENT OF DEGENERATIVE DISEASES AND CERTAIN CANCERS DARWIN DISCOVERY LIMITED (GB) 2002-10-15 US disclosed