SCHEMBL9018395

SCHEMBL9018395

CC(C)(C)c1cc(CNC(=O)C=Cc2ccc(O)cc2)cc(C(C)(C)C)c1O

nearest known ligand 0.61

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ MMP1 P03956 5/20 0.61
▸ MMP2 P08253 5/20 0.61
▸ MMP9 P14780 5/20 0.61
▸ MAOB P27338 2/20 0.52
▸ BCHE P06276 1/20 0.49
▸ ACHE P22303 1/20 0.49
▸ KDM4E B2RXH2 1/20 0.48
▸ LMNA P02545 1/20 0.48
▸ TP53 P04637 1/20 0.48
▸ TNFRSF1A P19438 1/20 0.47
▸ MAOA P21397 1/20 0.47

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
SCHEMBL9567391 0.90 SMN1; SMN2 (0.58) MMP1MMP2MMP9MAOBBCHE
SCHEMBL9018321 0.90 MMP1 (0.49) MMP1MMP2MMP9MAOBBCHE
SCHEMBL9018276 0.90 MMP1 (0.49) MMP1MMP2MMP9MAOBBCHE
SCHEMBL11304615 0.90 MMP1 (0.63) MMP1MMP2MMP9MAOBBCHE
SCHEMBL11304619 0.90 MMP1 (0.63) MMP1MMP2MMP9MAOBBCHE
SCHEMBL9018291 0.89 MMP1 (0.51) MMP1MMP2MMP9MAOBBCHE
SCHEMBL9018405 0.88 HDAC3 (0.54) MMP1MMP2MMP9MAOBBCHE
SCHEMBL9018385 0.88 MMP1 (0.47) MMP1MMP2MMP9MAOBBCHE
SCHEMBL9018355 0.88 MMP1 (0.65) MMP1MMP2MMP9BCHEACHE
SCHEMBL9018438 0.86 LMNA (0.58) MAOBACHELMNATP53MAOA

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-0600949-B1 NEW 3,5-DI-TERT.BUTYL-4-HYDROXYPHENYL DERIVATIVES, METHODS OF PREPARING THEM AND DRUGS CONTAINING THEM BOEHRINGER MANNHEIM GMBH (DE) 1996-01-10 — — EP disclosed
EP-0600949-A1 NEW 3,5-DI-TERT.BUTYL-4-HYDROXYPHENYL DERIVATIVES, METHODS OF PREPARING THEM AND DRUGS CONTAINING THEM. BOEHRINGER MANNHEIM GMBH (DE) 1994-06-15 — — EP disclosed
WO-1993004035-A1 NEW 3,5-DI-TERT.BUTYL-4-HYDROXYPHENYL DERIVATIVES, METHODS OF PREPARING THEM AND DRUGS CONTAINING THEM BOEHRINGER MANNHEIM GMBH (DE) 1993-03-04 — — WO disclosed
EP-0527458-A1 New 3,5-di-tert.-butyl-4-hydroxyphenyl derivatives, process for their preparation and pharmaceutical compounds Roche Diagnostics GmbH (DE) 1993-02-17 — — EP disclosed
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