SCHEMBL11444906

SCHEMBL11444906

CCOc1cc2c(c3oc(C(=O)O)cc(=O)c13)CCC(C)(C)O2

nearest known ligand 0.58

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ POLB P06746 5/20 0.54
▸ KMT2A Q03164 7/20 0.52
▸ MEN1 O00255 6/20 0.52
▸ RCE1 Q9Y256 1/20 0.51

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
SCHEMBL11445047 0.88 POLB (0.63) POLBKMT2AMEN1RCE1
SCHEMBL11543143 0.78 POLB (0.58) POLBKMT2AMEN1RCE1
SCHEMBL17211707 0.70 MEN1 (0.71) POLBKMT2AMEN1
SCHEMBL15832516 0.65 GPR35 (0.72) POLBKMT2AMEN1
SCHEMBL2643933 0.64 TSHR (0.43) POLB
SCHEMBL11502584 0.62 KMT2A (0.43) KMT2AMEN1
SCHEMBL11546288 0.60 ABCB11 (0.67) POLBKMT2AMEN1
SCHEMBL9847122 0.60 GPR35 (0.54) POLBKMT2AMEN1
SCHEMBL11246518 0.60 GPR35 (0.63) KMT2AMEN1
SCHEMBL11310597 0.60 ABCB11 (0.83) POLBKMT2AMEN1

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-4238606-A ANTIALLERGANS FISONS LIMITED (GB) 1980-12-09 — — US disclosed
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