SCHEMBL7076424

SCHEMBL7076424

COC(=O)c1ccccc1S(=O)(=O)N1CCC(Oc2ccc(Cl)cc2)CC1

nearest known ligand 0.61

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MMP2 P08253 3/20 0.61
MMP13 P45452 3/20 0.61
ACLY P53396 1/20 0.54
HSD17B10 Q99714 3/20 0.52
SMN1; SMN2 Q16637 2/20 0.52
MAPT P10636 1/20 0.52
POLB P06746 1/20 0.51
FPR2 P25090 4/20 0.50
PROKR1 Q8TCW9 4/20 0.50
ALDH1A1 P00352 2/20 0.48
HPGD P15428 2/20 0.48
KDM4E B2RXH2 1/20 0.48
FAAH O00519 1/20 0.48
LMNA P02545 1/20 0.48

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
SCHEMBL7076681 0.88 ACLY (0.60) MMP2MMP13ACLYSMN1; SMN2MAPT
SCHEMBL7074343 0.87 MMP2 (0.76) MMP2MMP13ACLYSMN1; SMN2MAPT
SCHEMBL7072160 0.83 LMNA (0.57) HSD17B10MAPTPOLBFPR2PROKR1
SCHEMBL7079580 0.82 MMP13 (0.48) MMP2MMP13ACLYHSD17B10MAPT
SCHEMBL7080602 0.80 MAPT (0.65) ACLYHSD17B10SMN1; SMN2MAPTPOLB
SCHEMBL7076372 0.79 ACLY (0.53) MMP2MMP13ACLYSMN1; SMN2MAPT
SCHEMBL7072306 0.78 ACLY (0.57) MMP2MMP13ACLYFPR2PROKR1
SCHEMBL7076370 0.78 MMP2 (0.53) MMP2MMP13ACLYFPR2PROKR1
SCHEMBL8363776 0.78 MMP2 (0.60) MMP2MMP13ACLYSMN1; SMN2MAPT
SCHEMBL8337431 0.77 CA1 (0.58) HSD17B10SMN1; SMN2POLBALDH1A1HPGD

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 4 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
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