SCHEMBL7960060

SCHEMBL7960060

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

nearest known ligand 0.65

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MMP2 P08253 9/20 0.65
MMP9 P14780 7/20 0.65
ADAMTS4 O75173 1/20 0.62
ADAMTS5 Q9UNA0 1/20 0.55
ALDH1A1 P00352 1/20 0.55
MAPT P10636 1/20 0.55
MMP1 P03956 1/20 0.55
MMP3 P08254 1/20 0.55
MMP7 P09237 1/20 0.55
MMP13 P45452 1/20 0.55
CTSL P07711 5/20 0.53
CTSS P25774 5/20 0.53
CTSK P43235 4/20 0.53
CTSB P07858 2/20 0.53
POLB P06746 1/20 0.52
MEN1 O00255 2/20 0.50
KMT2A Q03164 2/20 0.50
L3MBTL1 Q9Y468 2/20 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
SCHEMBL7970164 0.86 MMP2 (0.62) MMP2MMP9ADAMTS4ADAMTS5ALDH1A1
SCHEMBL7960292 0.85 MMP9 (0.62) MMP2MMP9ADAMTS4ADAMTS5ALDH1A1
SCHEMBL4610522 0.84 MMP2 (0.67) MMP2MMP9ADAMTS4ADAMTS5ALDH1A1
SCHEMBL697592 0.83 MMP2 (0.85) MMP2MMP9ADAMTS4ADAMTS5ALDH1A1
SCHEMBL4188026 0.83 MMP2 (0.85) MMP2MMP9ADAMTS4ADAMTS5ALDH1A1
SCHEMBL697591 0.83 MMP2 (0.85) MMP2MMP9ADAMTS4ADAMTS5ALDH1A1
SCHEMBL19450360 0.81 MMP2 (0.67) MMP2MMP9ADAMTS4ADAMTS5ALDH1A1
SCHEMBL6019308 0.80 CTSS (0.64) MMP2MMP9ADAMTS4CTSLCTSS
SCHEMBL2454204 0.79 MMP2 (1.00) MMP2MMP9ADAMTS4ADAMTS5ALDH1A1
SCHEMBL20233209 0.79 BCAT1 (0.53) MMP2MMP9ALDH1A1MAPTCTSL

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
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