SCHEMBL7976144

SCHEMBL7976144

O=C(NNC(=O)C(Cc1ccccc1)NS(=O)(=O)c1ccc2ccccc2c1)c1ccccc1

nearest known ligand 0.59

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
KAT6A Q92794 3/20 0.59
PLG P00747 4/20 0.56
MMP9 P14780 2/20 0.55
NPY5R Q15761 1/20 0.55
F10 P00742 3/20 0.53
PLAU P00749 1/20 0.53
MMP2 P08253 1/20 0.53
F2 P00734 2/20 0.53
TACR1 P25103 1/20 0.51
POLB P06746 1/20 0.51

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
SCHEMBL7971563 0.91 KAT6A (0.53) KAT6APLGMMP9NPY5RF10
SCHEMBL7960292 0.87 MMP9 (0.62) KAT6AMMP9MMP2TACR1
SCHEMBL7959981 0.85 NPY5R (0.55) PLGMMP9NPY5RMMP2F2
SCHEMBL31086902 0.85 MMP2 (0.73) MMP9NPY5RMMP2F2POLB
SCHEMBL3310154 0.83 MMP2 (0.71) MMP9NPY5RMMP2F2POLB
SCHEMBL31086814 0.83 MMP2 (0.71) MMP9NPY5RMMP2F2POLB
SCHEMBL7290941 0.83 MMP2 (0.71) MMP9NPY5RMMP2F2POLB
SCHEMBL5189194 0.83 MMP2 (0.71) MMP9NPY5RMMP2F2POLB
SCHEMBL10830546 0.81 F2 (0.58) PLGMMP9NPY5RMMP2F2
SCHEMBL5780617 0.81 F2 (0.61) PLGMMP9NPY5RF10PLAU

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6271247-B1 BINDING TO NEUROPEPTIDE RECEPTORS ADIR ET COMPAGNIE (FR) 2001-08-07 US disclosed
US-6172108-B1 NEUROPEPTIDE Y RECEPTOR LIGANDS; TREATING PSYCHOLOGICAL, EATING, SLEEP, AND SEXUAL DISORDERS; HYPOTENSIVE, ANXIOLYTIC, ANTIDEPRESSANT, AND ANTIDIABETIC AGENTS ADIR ET COMPAGNIE (FR) 2001-01-09 US disclosed
EP-1010691-A2 Hydrazide derivatives, process for their preparation and pharmaceutical compositions containing them ADIR ET COMPAGNIE (FR) 2000-06-21 EP disclosed