SCHEMBL17075907

SCHEMBL17075907

OC(CC(O)c1ccccc1)c1ccccc1.OC(CC(O)c1ccccc1)c1ccccc1.OC(CC(O)c1ccccc1)c1ccccc1.OC(CC(O)c1ccccc1)c1ccccc1.[Zr]

nearest known ligand 0.61

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.61
KDM4E B2RXH2 1/20 0.58
L3MBTL1 Q9Y468 1/20 0.58
AOC3 Q16853 5/20 0.54
RIPK1 Q13546 1/20 0.50
BCAT2 O15382 1/20 0.47
NPC1 O15118 1/20 0.45
RAB9A P51151 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
MAPK1 P28482 1/20 0.44
TSHR P16473 1/20 0.44

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
SCHEMBL3096547 0.97 LMNA (0.64) LMNAKDM4EL3MBTL1AOC3RIPK1
SCHEMBL5502611 0.97 LMNA (0.64) LMNAKDM4EL3MBTL1AOC3RIPK1
SCHEMBL75867 0.97 LMNA (0.64) LMNAKDM4EL3MBTL1AOC3RIPK1
SCHEMBL3096537 0.97 LMNA (0.64) LMNAKDM4EL3MBTL1AOC3RIPK1
SCHEMBL12213295 0.97 LMNA (0.64) LMNAKDM4EL3MBTL1AOC3RIPK1
SCHEMBL16909341 0.94 LMNA (0.61) LMNAKDM4EL3MBTL1AOC3RIPK1
SCHEMBL31620295 0.94 LMNA (0.61) LMNAKDM4EL3MBTL1AOC3RIPK1
SCHEMBL8031288 0.94 LMNA (0.61) LMNAKDM4EL3MBTL1AOC3RIPK1
Ethylene Glycol SCHEMBL28869316 0.90 LMNA (0.56) LMNAKDM4EL3MBTL1AOC3RIPK1
Acetic Acid SCHEMBL18759625 0.85 LMNA (0.58) LMNAKDM4EL3MBTL1AOC3RIPK1

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-2895517-B1 TWO-COMPONENT POLYURETHANE COMPOSITION SIKA TECH AG (CH) 2020-12-16 EP claimed
US-20150259465-A1 TWO-COMPONENT POLYURETHANE COMPOSITION SIKA TECHNOLOGY AG (CH) 2015-09-17 US claimed
US-20150259465-A1 TWO-COMPONENT POLYURETHANE COMPOSITION SIKA TECHNOLOGY AG (CH) 2015-09-17 US disclosed