SCHEMBL7072097

SCHEMBL7072097

O=C(O)Cc1ccccc1S(=O)(=O)N1CCN(c2ccccn2)CC1

nearest known ligand 0.59

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.59
KDM4E B2RXH2 9/20 0.55
MAPT P10636 1/20 0.55
KMT2A Q03164 4/20 0.55
MEN1 O00255 3/20 0.55
POLB P06746 1/20 0.55
PKM P14618 1/20 0.54
LMNA P02545 2/20 0.53
L3MBTL1 Q9Y468 2/20 0.52
HSD17B10 Q99714 3/20 0.51
CYP3A4 P08684 2/20 0.51
CYP2C9 P11712 1/20 0.51
HPGD P15428 1/20 0.51
RECQL P46063 1/20 0.51
CYP1A2 P05177 1/20 0.50
CYP2C19 P33261 1/20 0.50
SMN1; SMN2 Q16637 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
SCHEMBL7072805 0.87 ALDH1A1 (0.56) ALDH1A1KDM4EMAPTKMT2AMEN1
SCHEMBL7080549 0.82 PKM (0.62) ALDH1A1KDM4EMAPTKMT2AMEN1
SCHEMBL2963306 0.78 ALDH1A1 (0.68) ALDH1A1KDM4EMAPTKMT2AMEN1
SCHEMBL7072432 0.77 CNR1 (0.48) ALDH1A1MAPTKMT2AMEN1POLB
SCHEMBL7073733 0.77 MAPT (0.49) ALDH1A1KDM4EMAPTKMT2AMEN1
SCHEMBL5774422 0.77 SMN1; SMN2 (0.53) ALDH1A1KDM4EKMT2AMEN1PKM
SCHEMBL4324132 0.76 KDM4E (0.79) ALDH1A1KDM4EMAPTKMT2AMEN1
SCHEMBL7079810 0.76 ALDH1A1 (0.59) ALDH1A1KDM4EMAPTKMT2AMEN1
SCHEMBL7076647 0.75 MEN1 (0.60) ALDH1A1KDM4EMAPTKMT2AMEN1
SCHEMBL2960545 0.75 ALDH1A1 (0.75) ALDH1A1KDM4EMAPTKMT2AMEN1

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 5 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 claimed
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
EP-1163213-A1 HYDROXAMIC AND CARBOXYLIC ACID DERIVATIVES Darwin Discovery Limited (GB) 2001-12-19 EP disclosed
WO-2000056704-A1 HYDROXAMIC AND CARBOXYLIC ACID DERIVATIVES DARWIN DISCOVERY LIMITED (GB) 2000-09-28 WO disclosed