SCHEMBL11190532

SCHEMBL11190532

O=C(O)C(=O)c1ccc(CC2CCCC2)cc1

nearest known ligand 0.46

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PTPRC P08575 2/20 0.46
PTPN1 P18031 2/20 0.46
PTPN2 P17706 1/20 0.46
GAA P10253 1/20 0.44
CPT1B Q92523 1/20 0.44
CHEK2 O96017 1/20 0.42
HDAC6 Q9UBN7 1/20 0.42
KMT2A Q03164 3/20 0.41
MEN1 O00255 2/20 0.41
GRIN1 Q05586 1/20 0.41
GRIN2B Q13224 1/20 0.41
PTPRF P10586 1/20 0.41

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
SCHEMBL11228193 0.84 KMT2A (0.58) GAACHEK2HDAC6KMT2AMEN1
SCHEMBL11191286 0.83 GAA (0.43) GAACHEK2HDAC6KMT2AMEN1
SCHEMBL11184150 0.80 KMT2A (0.53) CHEK2KMT2AMEN1
SCHEMBL25909564 0.79 KMT2A (0.52) CHEK2HDAC6KMT2AMEN1
SCHEMBL31276700 0.79 KMT2A (0.52) CHEK2HDAC6KMT2AMEN1
SCHEMBL11180540 0.79 KMT2A (0.52) CHEK2HDAC6KMT2AMEN1
SCHEMBL9063736 0.78 CA2 (0.50) GAAKMT2AMEN1GRIN1GRIN2B
SCHEMBL2812600 0.77 KMT2A (0.56) GAAKMT2AMEN1
SCHEMBL31276938 0.76 KMT2A (0.59) GAAKMT2AMEN1
SCHEMBL28325439 0.76 GAA (0.60) GAACHEK2

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
US-4407823-A ANTIINFLAMMATORY AGENTS SCHERING AKTIENGESELLSCHAFT (DE) 1983-10-04 US disclosed
EP-0007319-A1 Indan-1-carboxylic acid derivatives,process for their preparation and pharmaceutical preparations containing these compounds SCHERING AKTIENGESELLSCHAFT (DE) 1980-02-06 EP disclosed