SCHEMBL7364401

SCHEMBL7364401

O=CN(O)CC(c1ccc(Cl)c(Cl)c1)S(=O)(=O)N1CCN(c2cc(Cl)ncn2)CC1

nearest known ligand 0.36

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
OGA O60502 1/20 0.36
AKT1 P31749 2/20 0.33
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31
KDM4E B2RXH2 1/20 0.31
PKM P14618 1/20 0.31
HTR1A P08908 1/20 0.30
HTR7 P34969 1/20 0.30

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
SCHEMBL7356361 0.85 PANK3 (0.39) OGAHTR1AHTR7
SCHEMBL4809534 0.80 MMP13 (0.39) OGAAKT1MEN1KMT2AKDM4E
SCHEMBL4814260 0.73 OGA (0.38) OGAAKT1KDM4EPKMHTR1A
SCHEMBL7358595 0.71 MMP7 (0.38) OGAMEN1KMT2AKDM4EPKM
SCHEMBL7362584 0.71 GRM5 (0.35) KDM4E
SCHEMBL14252769 0.69 CYP3A4 (0.48) OGAKDM4E
SCHEMBL7358015 0.67 PANK3 (0.43) OGAKMT2AHTR1AHTR7
SCHEMBL4816479 0.66 MMP7 (0.51) OGAKDM4EPKM
SCHEMBL4813569 0.65 SMO (0.50) OGA
SCHEMBL4814569 0.65 MMP7 (0.46) OGAHTR1AHTR7

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
EP-1109787-A1 ARYLPIPERAZINES AND THEIR USE AS METALLOPROTEINASE INHIBITING AGENTS (MMP) AstraZeneca AB (SE) 2001-06-27 EP disclosed
WO-2000012478-A1 ARYLPIPERAZINES AND THEIR USE AS METALLOPROTEINASE INHIBITING AGENTS (MMP) ASTRAZENECA AB (SE) 2000-03-09 WO disclosed