SCHEMBL7090646

SCHEMBL7090646

Cc1sc(C)c([C@@H](C)O)c1Br

nearest known ligand 0.31

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
GPR35 Q9HC97 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
SCHEMBL7090652 1.00 GPR35 (0.31) GPR35
SCHEMBL3628098 0.70 ALDH1A1 (0.33)
SCHEMBL4100396 0.69
SCHEMBL12987847 0.69 FHIT (0.34) GPR35
SCHEMBL10535164 0.68 ALDH1A1 (0.37)
SCHEMBL25366386 0.66 PTGS2 (0.41)
SCHEMBL12732565 0.66 GSK3B (0.39)
SCHEMBL31398763 0.64 PTPN1 (0.31) GPR35
SCHEMBL14198892 0.62
SCHEMBL19667834 0.60 ALDH1A1 (0.36)

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101314608-A Bidentate organophosphor ligand and uses thereof EVONIK DEGUSSA AG (DE) 2008-12-03 CN disclosed
US-6573389-B1 As catalysts for asymmetric reaction or polymerization DEGUSSA AG (DE) 2003-06-03 US disclosed