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Sugi Predict / Compounds / SCHEMBL7425965

SCHEMBL7425965

SCHEMBL7425965

CCCCCCCCC(=O)NC(Cc1ccccc1)C(=O)NC(C(=O)Nc1n[nH]c(=S)s1)C(C)C

nearest known ligand 0.61

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ MMP3 P08254 10/20 0.61
▸ MMP1 P03956 11/20 0.57
▸ MMP2 P08253 9/20 0.57
▸ MMP8 P22894 8/20 0.55
▸ MMP9 P14780 7/20 0.55
▸ PSMB5 P28074 2/20 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
SCHEMBL7425970 1.00 MMP3 (0.61) MMP3MMP1MMP2MMP8MMP9
SCHEMBL7396121 0.90 MMP3 (0.66) MMP3MMP1MMP2MMP8MMP9
SCHEMBL7356790 0.82 MMP3 (0.64) MMP3MMP1MMP2MMP8MMP9
SCHEMBL7356783 0.82 MMP3 (0.64) MMP3MMP1MMP2MMP8MMP9
SCHEMBL7361337 0.82 MMP3 (0.64) MMP3MMP1MMP2MMP8MMP9
SCHEMBL7361333 0.82 MMP3 (0.64) MMP3MMP1MMP2MMP8MMP9
SCHEMBL6956269 0.79 MMP3 (0.77) MMP3MMP1MMP2
SCHEMBL7423329 0.78 MMP1 (0.59) MMP3MMP1MMP2MMP8MMP9
SCHEMBL6958185 0.78 MMP3 (0.69) MMP3MMP1MMP2MMP8MMP9
SCHEMBL8896527 0.77 MMP3 (0.57) MMP3MMP1MMP2MMP8MMP9

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-1998025949-A1 SUBSTITUTED 5-AMINO-1,3,4-THIADIAZOLE-2-THIONES PROSCRIPT, INC. (US) 1998-06-18 — — WO disclosed
US-5677282-A ENZYME INHIBITOR; OSTEOARTHRITIS AND RHEUMATIC DISORDERS PROSCRIPT, INC. (US) 1997-10-14 — — US disclosed