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Sugi Predict / Compounds / SCHEMBL6973528

SCHEMBL6973528

SCHEMBL6973528

Cc1cc(C2CCN(S(=O)(=O)C(C)(C)C(=O)NO)CC2)ccc1-c1cccc(OCCN)c1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ MMP3 P08254 13/20 1.00
▸ MMP2 P08253 11/20 1.00
▸ MMP1 P03956 2/20 0.88
▸ MMP9 P14780 2/20 0.88
▸ MMP14 P50281 2/20 0.88
▸ SUCNR1 Q9BXA5 1/20 0.36
▸ PKM P14618 1/20 0.34
▸ USP5 P45974 1/20 0.34
▸ HTR7 P34969 1/20 0.34

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
Hydrochloric Acid SCHEMBL6971643 0.99 MMP3 (0.98) MMP3MMP2MMP1MMP9MMP14
SCHEMBL6585851 0.94 MMP3 (1.00) MMP3MMP2MMP1MMP9MMP14
SCHEMBL6586804 0.92 MMP3 (1.00) MMP3MMP2MMP1MMP9MMP14
SCHEMBL6972635 0.91 MMP3 (1.00) MMP3MMP2MMP1MMP9MMP14
SCHEMBL6434351 0.91 MMP2 (0.84) MMP3MMP2MMP1MMP9MMP14
SCHEMBL6585076 0.91 MMP3 (1.00) MMP3MMP2MMP1MMP9MMP14
SCHEMBL6966079 0.91 MMP3 (1.00) MMP3MMP2MMP1MMP9MMP14
Hydrochloric Acid SCHEMBL6962275 0.91 MMP3 (0.98) MMP3MMP2MMP1MMP9MMP14
Hydrochloric Acid SCHEMBL6437234 0.90 MMP2 (0.82) MMP3MMP2MMP1MMP9MMP14
Dimethylamine SCHEMBL6974207 0.89 MMP3 (0.97) MMP3MMP2MMP1MMP9MMP14

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1181017-B1 METALLOPROTEASE INHIBITORS PFIZER LTD (GB) 2003-04-16 — — EP claimed