SCHEMBL5665308

SCHEMBL5665308

CCCCCCOOCCC(C)C

nearest known ligand 0.39

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
DNM1 Q05193 3/20 0.39
THRB P10828 2/20 0.38
TSHR P16473 1/20 0.38
OPRM1 P35372 1/20 0.37
MEN1 O00255 1/20 0.37
HTT P42858 1/20 0.37
KMT2A Q03164 1/20 0.37
MAPT P10636 1/20 0.37
USP2 O75604 1/20 0.36
SPHK1 Q9NYA1 1/20 0.36
LPAR3 Q9UBY5 4/20 0.35
LPAR2 Q9HBW0 3/20 0.35
CA1 P00915 3/20 0.35
CA2 P00918 3/20 0.35
CA9 Q16790 3/20 0.35
LPAR1 Q92633 2/20 0.35
NAAA Q02083 1/20 0.35

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
SCHEMBL6335898 0.98 OPRM1 (0.39) DNM1THRBTSHROPRM1MEN1
SCHEMBL27278429 0.91 OPRM1 (0.42) DNM1THRBTSHROPRM1MEN1
SCHEMBL22442052 0.91 OPRM1 (0.42) DNM1THRBTSHROPRM1MEN1
SCHEMBL29253592 0.91 OPRM1 (0.42) DNM1THRBTSHROPRM1MEN1
SCHEMBL9149362 0.86 LMNA (0.40) DNM1OPRM1USP2SPHK1
SCHEMBL30589896 0.85 LMNA (0.43) CA1CA2CA9
SCHEMBL1067348 0.82 THRB (0.57) THRBTSHRMEN1HTTKMT2A
SCHEMBL3826183 0.82 THRB (0.57) THRBTSHRMEN1HTTKMT2A
SCHEMBL21218973 0.82 THRB (0.57) THRBTSHRMEN1HTTKMT2A
SCHEMBL2119344 0.82 THRB (0.57) THRBTSHRMEN1HTTKMT2A

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-7087705-B2 Process for the monoalkylation of dihydroxy aromatic compounds GENERAL ELECTRIC COMPANY (US) 2006-08-08 US claimed