SCHEMBL7651343

SCHEMBL7651343

O=C(c1ccc(Cl)cc1)C1CCN(C(=O)c2ccc3[nH]ccc3c2)CC1

nearest known ligand 0.66

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
MGLL Q99685 18/20 0.66
MEN1 O00255 1/20 0.60
KMT2A Q03164 1/20 0.60
HSD11B1 P28845 1/20 0.59

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
SCHEMBL1807533 0.84 CHRNA7 (0.53)
SCHEMBL1063085 0.83 CCR3 (0.72) MEN1KMT2A
SCHEMBL30226931 0.78 MAPK14 (0.64) MGLL
SCHEMBL22216445 0.78 MAPK14 (0.64) MGLLHSD11B1
SCHEMBL30329646 0.78 MAPK14 (0.64) MGLLHSD11B1
SCHEMBL8534513 0.78 MAPK14 (0.64) MGLL
SCHEMBL3455621 0.78 KDM4E (0.59) MEN1KMT2A
SCHEMBL22216202 0.78 DRD2 (0.57) MGLL
SCHEMBL14559807 0.77 GPR183 (0.54) MGLL
SCHEMBL3455562 0.77 L3MBTL3 (0.71)

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
WO-2001056974-A2 INHA INHIBITORS AND THEIR USE AS ANTIBACTERIALS GENZYME CORPORATION (US) 2001-08-09 WO claimed
US-6372752-B1 ENZYME INHIBITORS, RESPIRATORY SYSTEM DISORDERS, TUBERCULOSIS AND MYCOBACTERIUM BACTERICIDES GENZYME CORPORATION 2002-04-16 US disclosed