Sugi Predict

Sugi Predict / Compounds / SCHEMBL6971565

SCHEMBL6971565

SCHEMBL6971565

Cc1cc(C2CCN(S(=O)(=O)C3(C(=O)NO)CCOCC3)CC2)ccc1-c1cccc(OCCNC(=O)OC(C)(C)C)c1

nearest known ligand 0.58

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ MMP2 P08253 17/20 0.58
▸ MMP3 P08254 8/20 0.58
▸ MMP9 P14780 6/20 0.56
▸ MMP1 P03956 3/20 0.56
▸ MMP14 P50281 3/20 0.56
▸ MMP13 P45452 9/20 0.38
▸ MMP8 P22894 3/20 0.38
▸ PDK2 Q15119 1/20 0.36
▸ ADAM17 P78536 1/20 0.36
▸ ADAM10 O14672 1/20 0.36

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
SCHEMBL6966018 0.93 MMP2 (0.56) MMP2MMP3MMP9MMP1MMP14
SCHEMBL6433636 0.93 MMP2 (0.55) MMP2MMP3MMP9MMP1MMP14
SCHEMBL6437460 0.93 MMP2 (0.55) MMP2MMP3MMP9MMP1MMP14
SCHEMBL6968408 0.88 MMP2 (0.67) MMP2MMP3MMP9MMP1MMP14
Hydrochloric Acid SCHEMBL6972714 0.87 MMP2 (0.66) MMP2MMP3MMP9MMP1MMP14
SCHEMBL6587889 0.87 MMP2 (0.65) MMP2MMP3MMP9MMP1MMP14
SCHEMBL7415783 0.86 MMP2 (0.65) MMP2MMP3MMP9MMP1MMP14
SCHEMBL6585463 0.84 MMP2 (0.53) MMP2MMP3MMP9MMP1MMP14
SCHEMBL6966390 0.83 MMP2 (0.54) MMP2MMP3MMP9MMP1MMP14
SCHEMBL6966219 0.83 MMP2 (0.54) MMP2MMP3MMP9MMP1MMP14

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