SCHEMBL30468892

SCHEMBL30468892

CCC1(C(N)=O)CCCCC1C

nearest known ligand 0.34

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 1/20 0.34
MAPT P10636 1/20 0.30

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
SCHEMBL13464578 0.83 CYP1A2 (0.33) MAPT
SCHEMBL11402312 0.81 MAPT (0.30) MAPT
SCHEMBL21806005 0.80 NAAA (0.36) EPHX1
SCHEMBL28867038 0.80 EPHX1 (0.37) EPHX1
SCHEMBL11293309 0.80 CYP3A4 (0.31) EPHX1
SCHEMBL28867035 0.79 SLC1A2 (0.34)
SCHEMBL11401948 0.79 OPRL1 (0.31)
SCHEMBL21611752 0.77 EPHX1 (0.32) EPHX1
SCHEMBL16116754 0.77 CYP1A2 (0.38)
SCHEMBL11295589 0.76 EPHX1 (0.40) EPHX1

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
WO-2023110474-A1 NON-TOBACCO, NICOTINE-CONTAINING COMPOSITION, METHOD FOR PREPARING THE SAME AND A NON-TOBACCO, NICOTINE-CONTAINING PRODUCT COMPRISING THE SAME ARNOLD ANDRÉ GMBH & CO. KG (DE) 2023-06-22 WO disclosed