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Sugi Predict / Compounds / SCHEMBL10129669

SCHEMBL10129669

SCHEMBL10129669

CCC(C)(Oc1ccc(C2(c3ccc(Oc4cccc(C(C)(Cl)CP)c4C#N)cc3)CC3CCC2C3)cc1)c1cccc(Cl)c1C#N

nearest known ligand 0.33

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ ALOX5AP P20292 2/20 0.33
▸ HSD11B1 P28845 1/20 0.31

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
SCHEMBL10129305 0.83 ADORA3 (0.36) HSD11B1
SCHEMBL10129971 0.83 ADORA3 (0.36) HSD11B1
SCHEMBL10112906 0.79 ALOX5AP (0.46) ALOX5APHSD11B1
SCHEMBL14629708 0.73 HSD11B1 (0.36) HSD11B1
SCHEMBL14640016 0.71 MAPT (0.38) HSD11B1
SCHEMBL13342162 0.70 HSD11B1 (0.37) HSD11B1
SCHEMBL12872885 0.70 HSD11B1 (0.41) HSD11B1
SCHEMBL17750837 0.70 HSD11B1 (0.36) HSD11B1
SCHEMBL14629609 0.69 MAPT (0.34) HSD11B1
SCHEMBL13298968 0.69 MAPT (0.38) HSD11B1

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-20120052412-A1 POLYARYLENE BLOCK COPOLYMER HAVING SULFONIC ACID GROUP AND USE THEREOF HONDA MOTOR CO., LTD. (JP) 2012-03-01 — — US disclosed