SCHEMBL10429973

SCHEMBL10429973

CNC(=O)[C@H](Cc1ccc(OC)cc1)NC(=O)C(CC(C)C)C(C)C(=O)O

nearest known ligand 0.82

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ MMP1 P03956 19/20 0.82
▸ MMP3 P08254 4/20 0.82
▸ MMP9 P14780 2/20 0.82
▸ ADAM17 P78536 1/20 0.82
▸ MMP2 P08253 4/20 0.69
▸ MMP7 P09237 1/20 0.64
▸ MMP8 P22894 1/20 0.64
▸ MMP13 P45452 1/20 0.64

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
SCHEMBL29368148 0.90 MMP1 (1.00) MMP1MMP3MMP9ADAM17MMP2
SCHEMBL6850869 0.90 MMP1 (1.00) MMP1MMP3MMP9ADAM17MMP2
SCHEMBL10429916 0.88 MMP1 (0.77) MMP1MMP3MMP9ADAM17MMP2
SCHEMBL10451735 0.87 MMP1 (1.00) MMP1MMP3MMP9ADAM17MMP2
SCHEMBL10451722 0.85 MMP1 (0.83) MMP1MMP3MMP9ADAM17MMP2
SCHEMBL7278837 0.85 MMP1 (1.00) MMP1MMP3MMP9ADAM17MMP2
SCHEMBL7278840 0.85 MMP1 (1.00) MMP1MMP3MMP9ADAM17MMP2
SCHEMBL7278293 0.85 MMP1 (1.00) MMP1MMP3MMP9ADAM17MMP2
SCHEMBL7278285 0.85 MMP1 (1.00) MMP1MMP3MMP9ADAM17MMP2
SCHEMBL9650310 0.84 MMP1 (0.86) MMP1MMP3MMP9ADAM17

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0214639-B1 HYDROXAMIC ACID BASED COLLAGENASE INHIBITORS G.D. Searle & Co. (US) 1990-06-13 — — EP disclosed
US-4743587-A ANTIARTHRITIC AGENTS G. D. SEARLE & CO. (US) 1988-05-10 — — US disclosed
EP-0214639-A2 Hydroxamic acid based collagenase inhibitors G.D. Searle & Co. (US) 1987-03-18 — — EP disclosed
US-4599361-A ANTIARTHRITIC G. D. SEARLE & CO. (US) 1986-07-08 — — US disclosed
Send feedback