SCHEMBL9692986

SCHEMBL9692986

OCCCCc1ccc2ccccc2c1O

nearest known ligand 0.67

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
PTPN22 Q9Y2R2 1/20 0.47

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
SCHEMBL9748724 0.98 PTPN22 (0.46) PTPN22
SCHEMBL1843301 0.95 PTPN22 (0.48) PTPN22
SCHEMBL128082 0.87 PTPN22 (0.52) PTPN22
SCHEMBL2005766 0.84 TYR (0.51)
SCHEMBL9750200 0.84
SCHEMBL1657841 0.84 PTPN22 (0.46) PTPN22
SCHEMBL25199957 0.83 TYR (0.54)
SCHEMBL11134384 0.83 TYR (0.54)
SCHEMBL10353654 0.83 TYR (0.54)
SCHEMBL25205081 0.83 TYR (0.54)

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
EP-0512352-A2 Substituted carboxylic acid derivatives F. HOFFMANN-LA ROCHE AG (CH) 1992-11-11 EP disclosed