SCHEMBL7924931

SCHEMBL7924931

CC1(C)NC(=O)N(CC(CCS(=O)(=O)c2ccc(Oc3ccc(Cl)cc3)cc2)N(O)C=O)C1=O

nearest known ligand 0.83

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
MMP2 P08253 19/20 0.83
MMP1 P03956 14/20 0.83
MMP9 P14780 11/20 0.83
MMP3 P08254 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
SCHEMBL7924924 1.00 MMP2 (0.83) MMP2MMP1MMP9MMP3
SCHEMBL7361102 0.92 MMP2 (0.70) MMP2MMP1MMP9MMP3
SCHEMBL7916917 0.92 MMP2 (0.70) MMP2MMP1MMP9MMP3
SCHEMBL7449000 0.91 MMP2 (1.00) MMP2MMP1MMP9MMP3
SCHEMBL7991469 0.91 MMP2 (1.00) MMP2MMP1MMP9MMP3
SCHEMBL7506026 0.86 MMP2 (0.83) MMP2MMP1MMP9MMP3
SCHEMBL7454084 0.82 MMP2 (0.83) MMP2MMP1MMP9MMP3
SCHEMBL7922743 0.80 MMP2 (0.83) MMP2MMP1MMP9MMP3
SCHEMBL7362164 0.80 MMP2 (0.83) MMP2MMP1MMP9MMP3
SCHEMBL7502929 0.80 MMP2 (1.00) MMP2MMP1MMP9MMP3

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-6235786-B1 RHEUMATIC DISORDERS; BONE DISORDERS; ORAL DISEASES; ANTIULCER AGENTS; ANTITUMOR AGENTS ABBOTT LABORATORIES 2001-05-22 US claimed
US-6235786-B1 RHEUMATIC DISORDERS; BONE DISORDERS; ORAL DISEASES; ANTIULCER AGENTS; ANTITUMOR AGENTS ABBOTT LABORATORIES 2001-05-22 US disclosed