SCHEMBL14066748

SCHEMBL14066748

CCCCCCCCOCOC1CC(C)(C)N(OC(=O)C(C)(C)C)C(C)(C)C1

nearest known ligand 0.36

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 9/20 0.36
CES2 O00748 2/20 0.35
PRKCA P17252 3/20 0.33
NAAA Q02083 2/20 0.31
TSHR P16473 2/20 0.30
KMT2A Q03164 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
SCHEMBL1138597 0.82 TSHR (0.35) TSHRKMT2A
SCHEMBL1889760 0.79 EPHX2 (0.42) EPHX2CES2NAAATSHRKMT2A
SCHEMBL13788499 0.77 NAAA (0.47) EPHX2PRKCANAAAKMT2A
SCHEMBL15275683 0.74 NAAA (0.43) EPHX2PRKCANAAAKMT2A
SCHEMBL12862768 0.73 KMT2A (0.43) EPHX2PRKCANAAATSHRKMT2A
SCHEMBL4325797 0.72 TSHR (0.38) TSHRKMT2A
SCHEMBL1138561 0.72 TSHR (0.44) TSHRKMT2A
SCHEMBL14354917 0.72 NAAA (0.47) EPHX2PRKCANAAAKMT2A
SCHEMBL4018833 0.72 S1PR4 (0.33) EPHX2TSHRKMT2A
SCHEMBL13905890 0.71

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
US-20080234453-A1 Method of Preparing Ethylene Polymers by Controlled High Pressure Polymerization ROTH MICHAEL 2008-09-25 US disclosed