SCHEMBL7434865

SCHEMBL7434865

CC(C)(C)OC(=O)Cn1cc(C[C@@H](N)C(=O)O)c2ccccc21

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 3/20 0.58
▸ MAPT P10636 2/20 0.58
▸ RECQL P46063 1/20 0.58
▸ GAA P10253 1/20 0.45
▸ KMT2A Q03164 2/20 0.44
▸ POLB P06746 2/20 0.44
▸ SCN9A Q15858 1/20 0.43
▸ SLC7A5 Q01650 1/20 0.43
▸ KDM4E B2RXH2 2/20 0.43
▸ L3MBTL1 Q9Y468 2/20 0.42
▸ MEN1 O00255 1/20 0.41
▸ LMNA P02545 1/20 0.41
▸ MPO P05164 1/20 0.41
▸ TSHR P16473 1/20 0.41
▸ BLM P54132 1/20 0.41
▸ PMP22 Q01453 1/20 0.41
▸ HIF1A Q16665 1/20 0.41
▸ PTGS2 P35354 1/20 0.41
▸ HDAC10 Q969S8 1/20 0.41
▸ HDAC6 Q9UBN7 1/20 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
SCHEMBL16099676 1.00 ALDH1A1 (0.58) ALDH1A1MAPTRECQLGAAKMT2A
SCHEMBL30002479 1.00 ALDH1A1 (0.58) ALDH1A1MAPTRECQLGAAKMT2A
SCHEMBL16099677 1.00 ALDH1A1 (0.58) ALDH1A1MAPTRECQLGAAKMT2A
SCHEMBL30343690 1.00 ALDH1A1 (0.58) ALDH1A1MAPTRECQLGAAKMT2A
SCHEMBL19456372 0.84 ALDH1A1 (0.41) ALDH1A1MAPTRECQLGAAKMT2A
SCHEMBL30711166 0.84 PLA2G2A (0.48) ALDH1A1MAPTRECQLSCN9ASLC7A5
SCHEMBL19410203 0.84 PLA2G2A (0.48) ALDH1A1MAPTRECQLSCN9ASLC7A5
SCHEMBL19410201 0.84 PLA2G2A (0.48) ALDH1A1MAPTRECQLSCN9ASLC7A5
SCHEMBL16100108 0.84 CTSS (0.48) GAAPOLBSCN9AHDAC10HDAC6
SCHEMBL31407630 0.84 CTSS (0.48) GAAPOLBSCN9AHDAC10HDAC6

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-0916671-B1 Metalloprotease inhibitors, process for their preparation and pharmaceutical compositions containing them SERVIER LAB (FR) 2002-01-30 — — EP disclosed
US-6066633-A PREVENT TISSUE DEGRADATION ADIR ET COMPAGNIE (FR) 2000-05-23 — — US disclosed
EP-0916671-A1 Metalloprotease inhibitors, process for their preparation and pharmaceutical compositions containing them ADIR ET COMPAGNIE (FR) 1999-05-19 — — EP disclosed
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