SCHEMBL14609697

SCHEMBL14609697

Nc1cccc(-c2ccc(CCC(=O)Nc3cscc3C(=O)O)cc2)c1

nearest known ligand 0.58

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
HCAR2 Q8TDS4 19/20 0.58
LTB4R Q15722 1/20 0.46
CYP2C8 P10632 1/20 0.45
CYP2C9 P11712 1/20 0.45

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
SCHEMBL5062205 0.89 HCAR2 (0.64) HCAR2LTB4RCYP2C8CYP2C9
SCHEMBL5306464 0.84 HCAR2 (0.55) HCAR2LTB4R
SCHEMBL5306172 0.84 HCAR2 (0.76) HCAR2LTB4R
SCHEMBL5328705 0.81 KDM6B (0.56) HCAR2CYP2C8CYP2C9
SCHEMBL14609869 0.81 HCAR2 (0.57) HCAR2CYP2C8CYP2C9
SCHEMBL5293834 0.81 HCAR2 (0.54) HCAR2CYP2C8CYP2C9
SCHEMBL14609706 0.80 HCAR2 (0.53) HCAR2LTB4R
SCHEMBL5295939 0.80 HCAR2 (0.51) HCAR2CYP2C8CYP2C9
SCHEMBL5301758 0.79 HCAR2 (0.52) HCAR2CYP2C8CYP2C9
SCHEMBL5301209 0.79 HCAR2 (0.59) HCAR2LTB4R

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
WO-2007015744-A1 DISUBSTITUTED THIENYL COMPOUNDS AND THEIR USE AS PHARMACEUTICALS INCYTE CORPORATION (US) 2007-02-08 WO disclosed