SCHEMBL7287005

SCHEMBL7287005

O=[C]C(Cc1c[nH]cn1)NC(=O)C(CCCc1ccccc1)Cc1ccccc1

nearest known ligand 0.44

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ MMP2 P08253 15/20 0.44
▸ MMP3 P08254 7/20 0.44
▸ MMP1 P03956 4/20 0.44
▸ MMP7 P09237 1/20 0.44
▸ MMP9 P14780 3/20 0.40
▸ MMP14 P50281 2/20 0.37

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
SCHEMBL7287009 1.00 MMP2 (0.44) MMP2MMP3MMP1MMP7MMP9
SCHEMBL7287864 0.97 MMP3 (0.44) MMP2MMP3MMP1MMP7MMP9
SCHEMBL7287870 0.97 MMP3 (0.44) MMP2MMP3MMP1MMP7MMP9
SCHEMBL7293298 0.94 MMP1 (0.39) MMP3MMP1
SCHEMBL7293294 0.94 MMP1 (0.39) MMP3MMP1
SCHEMBL7292514 0.90 CTSL (0.40) MMP1
SCHEMBL7292510 0.90 CTSL (0.40) MMP1
SCHEMBL7302891 0.86 GLS (0.39) —
SCHEMBL7302898 0.86 GLS (0.39) —
SCHEMBL10826321 0.85 MMP1 (0.49) MMP2MMP3MMP1MMP7

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
EP-0264106-B1 5-Substituted amino-4-hydroxy-pentanoic acid derivatives and their use BANYU PHARMA CO LTD (JP) 1994-03-16 — — EP disclosed
US-4851387-A RENIN INHIBITORS BANYU PHARMACEUTICAL CO., LTD. (JP) 1989-07-25 — — US disclosed
EP-0264106-A2 5-Substituted amino-4-hydroxy-pentanoic acid derivatives and their use Banyu Pharmaceutical Co., Ltd. (JP) 1988-04-20 — — EP disclosed
Send feedback