SCHEMBL25906367

SCHEMBL25906367

CCO[C@H]1COCC1OCc1ccccc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PSEN1 P49768 4/20 0.42
PSEN2 P49810 4/20 0.42
APH1B Q8WW43 4/20 0.42
NCSTN Q92542 4/20 0.42
APH1A Q96BI3 4/20 0.42
PSENEN Q9NZ42 4/20 0.42
BCHE P06276 2/20 0.41
MAPT P10636 1/20 0.41
CYP2C19 P33261 1/20 0.41
CTSL P07711 2/20 0.40
CTSB P07858 2/20 0.40
CTSK P43235 2/20 0.40
CTSV O60911 1/20 0.40
CTSS P25774 1/20 0.40
CTSC P53634 1/20 0.40
CTSF Q9UBX1 1/20 0.40
ACHE P22303 1/20 0.40
OPRM1 P35372 1/20 0.38
OPRL1 P41146 1/20 0.38
CYP1A2 P05177 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
SCHEMBL6669362 0.83 PDE4D (0.46) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL6671515 0.83 PDE4D (0.46) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL9074021 0.83 PDE4D (0.46) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL9074022 0.83 PDE4D (0.46) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL6671511 0.83 PDE4D (0.46) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL23867782 0.82 BCHE (0.49) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL21374478 0.80 PDE4D (0.47) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL6671627 0.80 BCHE (0.49) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL18580339 0.79 PSEN1 (0.42) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL18580338 0.79 PSEN1 (0.42) PSEN1PSEN2APH1BNCSTNAPH1A

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-3839008-B1 LIQUID CRYSTAL MEDIUM MERCK PATENT GMBH (DE) 2023-07-26 EP disclosed