SCHEMBL7560610

SCHEMBL7560610

CC(C)(C)[Si](C)(C)O[C@@H](CC(=O)O)CC(=O)/C=C/c1ccc(Cl)cc1Cl

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.40
ALDH1A1 P00352 4/20 0.40
NPC1 O15118 4/20 0.40
RAB9A P51151 4/20 0.40
SMN1; SMN2 Q16637 2/20 0.40
POLB P06746 1/20 0.40
MEN1 O00255 5/20 0.40
KMT2A Q03164 5/20 0.40
KDM4E B2RXH2 3/20 0.40
GAA P10253 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
MAOB P27338 1/20 0.39
BACE1 P56817 1/20 0.39
LMNA P02545 6/20 0.39
HTT P42858 2/20 0.39
CTDSP1 Q9GZU7 1/20 0.38
PKM P14618 1/20 0.38
HPGD P15428 2/20 0.38
CYP1A2 P05177 1/20 0.38
CYP2D6 P10635 1/20 0.38

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
SCHEMBL7565979 1.00 MAPT (0.40) MAPTALDH1A1NPC1RAB9ASMN1; SMN2
SCHEMBL7565968 1.00 MAPT (0.40) MAPTALDH1A1NPC1RAB9ASMN1; SMN2
SCHEMBL7560623 1.00 MAPT (0.40) MAPTALDH1A1NPC1RAB9ASMN1; SMN2
SCHEMBL8624259 0.80 MAPT (0.40) MAPTALDH1A1NPC1RAB9ASMN1; SMN2
SCHEMBL7560426 0.78 BACE1 (0.45) MAPTALDH1A1NPC1RAB9ASMN1; SMN2
SCHEMBL7560422 0.78 BACE1 (0.45) MAPTALDH1A1NPC1RAB9ASMN1; SMN2
SCHEMBL7558251 0.76 ABCB1 (0.34) ALDH1A1SMN1; SMN2L3MBTL1
SCHEMBL7558259 0.76 ABCB1 (0.34) ALDH1A1SMN1; SMN2L3MBTL1
SCHEMBL7558387 0.75 MAPT (0.50) MAPTALDH1A1NPC1RAB9ASMN1; SMN2
SCHEMBL7558379 0.75 MAPT (0.50) MAPTALDH1A1NPC1RAB9ASMN1; SMN2

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-0705837-B1 Preparation of 3-Oxy-5-oxo-6-heptenoic acid derivatives UBE INDUSTRIES (JP) 2002-08-07 EP disclosed
US-5744604-A Preparation of 3-oxy-5-oxo-6-heptenoic acid derivatives UBE INDUSTRIES, LTD. (JP) 1998-04-28 US disclosed
US-5677455-A Preparation of 3-oxy-5-oxo-6-heptenoic acid derivatives UBE INDUSTRIES, LTD. (JP) 1997-10-14 US disclosed
EP-0705837-A2 Preparation of 3-Oxy-5-oxo-6-heptenoic acid derivatives UBE INDUSTRIES, LTD. (JP) 1996-04-10 EP disclosed