SCHEMBL7292804

SCHEMBL7292804

O=C1NC(CC2CCCCC2)C(C2SCCS2)O1

nearest known ligand 0.33

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ CTSD P07339 1/20 0.31
▸ MMP1 P03956 4/20 0.30
▸ MMP9 P14780 3/20 0.30
▸ MMP7 P09237 2/20 0.30
▸ HSD11B1 P28845 1/20 0.30
▸ MMP3 P08254 1/20 0.30

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
SCHEMBL7288590 0.96 CTSD (0.30) CTSD
SCHEMBL7270971 0.79 MMP1 (0.31) MMP1MMP9MMP7MMP3
SCHEMBL7299395 0.78 MMP1 (0.31) MMP1MMP9MMP7MMP3
SCHEMBL7290039 0.71 MMP1 (0.32) CTSDMMP1MMP9MMP7MMP3
SCHEMBL7282942 0.71 MMP1 (0.32) CTSDMMP1MMP9MMP7MMP3
SCHEMBL8908550 0.70 KDM6B (0.32) CTSDMMP1MMP9MMP7MMP3
SCHEMBL7270999 0.70 MMP1 (0.31) MMP1MMP9MMP7MMP3
SCHEMBL9417461 0.70 KDM6B (0.32) CTSDMMP1MMP9MMP7MMP3
SCHEMBL9222144 0.70 MMP1 (0.31) MMP1MMP9MMP7MMP3
SCHEMBL7292526 0.70 MMP1 (0.31) MMP1MMP9MMP7MMP3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5442044-A Hypotensive agents PFIZER INC. (US) 1995-08-15 — — US disclosed
EP-0661292-A1 Orally active renin inhibitors PFIZER INC. (US) 1995-07-05 — — EP disclosed
EP-0438233-A2 Orally active renin inhibitors PFIZER INC. (US) 1991-07-24 — — EP disclosed
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