SCHEMBL7970164

SCHEMBL7970164

O=C(NNc1ccccc1)C(Cc1ccccc1)NS(=O)(=O)c1ccccc1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MMP2 P08253 9/20 0.62
MMP9 P14780 8/20 0.62
ADAMTS4 O75173 1/20 0.59
HDAC3 O15379 1/20 0.55
HDAC4 P56524 1/20 0.55
HDAC1 Q13547 1/20 0.55
HDAC2 Q92769 1/20 0.55
HDAC8 Q9BY41 1/20 0.55
ADAMTS5 Q9UNA0 1/20 0.53
ALDH1A1 P00352 1/20 0.53
MAPT P10636 1/20 0.53
MMP1 P03956 1/20 0.53
MMP3 P08254 1/20 0.53
MMP7 P09237 1/20 0.53
MMP13 P45452 1/20 0.53
CTSL P07711 5/20 0.52
CTSS P25774 5/20 0.52
CTSK P43235 4/20 0.52
CTSB P07858 2/20 0.51
POLB P06746 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
SCHEMBL28745570 0.91 MMP2 (0.67) MMP2MMP9ADAMTS4HDAC3HDAC4
SCHEMBL7971489 0.88 MMP2 (0.59) MMP2MMP9HDAC3HDAC4HDAC1
SCHEMBL7959981 0.87 NPY5R (0.55) MMP2MMP9ADAMTS4HDAC3HDAC4
SCHEMBL7960060 0.86 MMP2 (0.65) MMP2MMP9ADAMTS4ADAMTS5ALDH1A1
SCHEMBL7960292 0.83 MMP9 (0.62) MMP2MMP9ADAMTS4ADAMTS5ALDH1A1
SCHEMBL4610522 0.82 MMP2 (0.67) MMP2MMP9ADAMTS4ADAMTS5ALDH1A1
SCHEMBL27516345 0.81 MMP2 (0.57) MMP2MMP9ADAMTS5ALDH1A1MAPT
SCHEMBL697592 0.81 MMP2 (0.85) MMP2MMP9ADAMTS4ADAMTS5ALDH1A1
SCHEMBL4188026 0.81 MMP2 (0.85) MMP2MMP9ADAMTS4ADAMTS5ALDH1A1
SCHEMBL697591 0.81 MMP2 (0.85) MMP2MMP9ADAMTS4ADAMTS5ALDH1A1

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