SCHEMBL8169574

SCHEMBL8169574

CN[C@H](Cc1ccccc1)C(=O)N[C@@H](CCCCNC(C)=O)C(=O)N(C)C

nearest known ligand 0.48

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ GNPAT O15228 1/20 0.48
▸ MMP8 P22894 2/20 0.48
▸ MMP9 P14780 1/20 0.48
▸ MMP14 P50281 1/20 0.48
▸ MMP1 P03956 3/20 0.44
▸ MMP3 P08254 1/20 0.44
▸ PTPN2 P17706 1/20 0.44
▸ PTPN1 P18031 1/20 0.44
▸ CTSS P25774 1/20 0.43
▸ CTSK P43235 1/20 0.43
▸ QRFPR Q96P65 1/20 0.42
▸ FOLH1 Q04609 2/20 0.42
▸ MMP2 P08253 4/20 0.41

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
SCHEMBL8169814 0.88 MMP1 (0.53) GNPATMMP8MMP9MMP1MMP3
SCHEMBL8169810 0.88 MMP1 (0.53) GNPATMMP8MMP9MMP1MMP3
SCHEMBL20653766 0.85 MMP9 (0.51) GNPATMMP8MMP9MMP14MMP1
SCHEMBL8164939 0.83 MMP9 (0.46) MMP8MMP9CTSSFOLH1
SCHEMBL8164942 0.83 MMP9 (0.46) MMP8MMP9CTSSFOLH1
SCHEMBL8164922 0.83 MMP9 (0.46) MMP8MMP9CTSSFOLH1
SCHEMBL8173933 0.80 REN (0.47) MMP8MMP9MMP14MMP1MMP3
SCHEMBL8173837 0.80 REN (0.47) MMP8MMP9MMP14MMP1MMP3
SCHEMBL6319141 0.77 MMP9 (0.66) MMP8MMP9MMP14MMP3
SCHEMBL7064976 0.77 MMP9 (0.66) MMP8MMP9MMP14MMP3

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-6127341-A AMINOMETHYL-N-(1-((2-(2-THIENYL)-1-(1-CARBAMOYL-5 -AMINOPENTYLCARBAMOYL)ETHYL)-N-METHYLCARBAMOYL)-2-(2 -NAPTHYL)ETHYL)BENZAMIDE, FOR EXAMPLE; ADMINISTERING TO STIMULATE GROWTH, MILK OR WOOL PRODUCTION IN ANIMALS NOVO NORDISK A/S (DK) 2000-10-03 — — US disclosed
EP-1005484-A1 COMPOUNDS WITH GROWTH HORMONE RELEASING PROPERTIES NOVO NORDISK A/S (DK) 2000-06-07 — — EP disclosed
WO-1998058950-A1 COMPOUNDS WITH GROWTH HORMONE RELEASING PROPERTIES NOVO NORDISK A/S (DK) 1998-12-30 — — WO disclosed
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