SCHEMBL29333473

SCHEMBL29333473

C=C(C)COc1ccc(-c2ccc(-c3ccc(OCCOC(=O)C(=C)C)c(OCCOC(=O)C(=C)C)c3)cc2)cc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ POLB P06746 3/20 0.44
▸ APEX1 P27695 1/20 0.44
▸ HTT P42858 1/20 0.44
▸ TDP1 Q9NUW8 1/20 0.44
▸ GPR174 Q9BXC1 1/20 0.40
▸ MAPT P10636 4/20 0.39
▸ MAPK1 P28482 3/20 0.39
▸ KDM4E B2RXH2 3/20 0.39
▸ HSD17B10 Q99714 2/20 0.39
▸ KMT2A Q03164 2/20 0.39
▸ NPC1 O15118 2/20 0.39
▸ RAB9A P51151 2/20 0.39
▸ SMN1; SMN2 Q16637 2/20 0.39
▸ MEN1 O00255 1/20 0.39
▸ TP53 P04637 1/20 0.39
▸ PDE4A P27815 2/20 0.39
▸ PDE4B Q07343 2/20 0.39
▸ PDE4C Q08493 2/20 0.39
▸ PDE4D Q08499 2/20 0.39
▸ TSHR P16473 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
SCHEMBL20355775 1.00 POLB (0.44) POLBAPEX1HTTTDP1GPR174
SCHEMBL15338837 0.88 THRB (0.45) POLBAPEX1HTTTDP1MAPT
SCHEMBL16559864 0.88 POLB (0.43) POLBAPEX1HTTTDP1MAPT
SCHEMBL15180381 0.88 POLB (0.43) POLBAPEX1HTTTDP1MAPT
SCHEMBL19497343 0.88 POLB (0.43) POLBAPEX1HTTTDP1MAPT
SCHEMBL20342982 0.86 THRB (0.40) POLBAPEX1HTTTDP1MAPT
SCHEMBL20355302 0.86 MAPT (0.43) POLBAPEX1HTTTDP1MAPT
SCHEMBL16559835 0.85 POLB (0.43) POLBAPEX1HTTTDP1MAPT
SCHEMBL21102080 0.85 POLB (0.43) POLBAPEX1HTTTDP1MAPT
SCHEMBL16559814 0.85 POLB (0.43) POLBAPEX1HTTTDP1MAPT

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4400561-A1 LIQUID-CRYSTAL MEDIUM Merck Patent GmbH (DE) 2024-07-17 — — EP disclosed
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