SCHEMBL6891983

SCHEMBL6891983

COc1ccccc1-c1cccc2c1[CH]c1ccccc1S2

nearest known ligand 0.45

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
GPR84 Q9NQS5 15/20 0.45
APP P05067 1/20 0.42
PTGS2 P35354 1/20 0.39
BCHE P06276 1/20 0.38
HTR7 P34969 1/20 0.37
ALDH1A1 P00352 1/20 0.37

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
SCHEMBL1127626 0.75 TRPA1 (0.39) GPR84PTGS2ALDH1A1
SCHEMBL218360 0.74 CA1 (0.46) APPPTGS2HTR7ALDH1A1
SCHEMBL6891987 0.73 FABP3 (0.35) GPR84BCHEALDH1A1
SCHEMBL27481143 0.71 PTGS2 (0.44) APPPTGS2HTR7ALDH1A1
SCHEMBL29429633 0.71 CA1 (0.71) APPHTR7ALDH1A1
SCHEMBL29788337 0.71 CA1 (0.71) APPHTR7ALDH1A1
SCHEMBL301996 0.71 CA1 (0.71) APPHTR7ALDH1A1
SCHEMBL29740506 0.69 CA1 (0.67) APPHTR7ALDH1A1
SCHEMBL30599266 0.69 CA1 (0.67) APPHTR7ALDH1A1
SCHEMBL3643541 0.69 CA1 (0.67) APPHTR7ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1412752-A4 METHODS AND COMPOSITIONS FOR DETERMINING THE PURITY OF AND PURIFYING CHEMICALLY SYNTHESIZED NUCLEIC ACIDS VERI Q INC (US) 2004-09-29 EP disclosed
WO-2003003014-A9 METHODS AND COMPOSITIONS FOR DETERMINING THE PURITY OF AND PURIFYING CHEMICALLY SYNTHESIZED NUCLEIC ACIDS VERI Q INC (US) 2004-05-13 WO disclosed
EP-1412752-A1 METHODS AND COMPOSITIONS FOR DETERMINING THE PURITY OF AND PURIFYING CHEMICALLY SYNTHESIZED NUCLEIC ACIDS VERI-Q, Inc. (US) 2004-04-28 EP disclosed
WO-2003003014-A1 METHODS AND COMPOSITIONS FOR DETERMINING THE PURITY OF AND PURIFYING CHEMICALLY SYNTHESIZED NUCLEIC ACIDS VERI-Q, INC. (US) 2003-01-09 WO disclosed