SCHEMBL6036702

SCHEMBL6036702

Nc1c(C(=O)O)cc2ccccc2c1O

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GPR35 Q9HC97 2/20 0.58
POLB P06746 2/20 0.58
LDHA P00338 1/20 0.58
CYP2D6 P10635 1/20 0.55
IDO1 P14902 1/20 0.55
GRIN2D O15399 1/20 0.50
GRIN2A Q12879 1/20 0.50
GRIN2B Q13224 1/20 0.50
GRIN2C Q14957 1/20 0.50
ME2 P23368 1/20 0.49
ME1 P48163 1/20 0.49
ME3 Q16798 1/20 0.49
MEN1 O00255 4/20 0.49
KMT2A Q03164 4/20 0.49
CDC25B P30305 2/20 0.49
RXFP1 Q9HBX9 1/20 0.49
HSD17B10 Q99714 4/20 0.49
HPGD P15428 3/20 0.49
CYP2C9 P11712 2/20 0.49
THRB P10828 1/20 0.49

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
SCHEMBL1224667 0.86 POLB (0.63) GPR35POLBLDHACYP2D6IDO1
SCHEMBL1224183 0.85 IDO1 (0.58) GPR35POLBLDHACYP2D6IDO1
SCHEMBL2856131 0.84 MAPT (0.50) GPR35POLBLDHACYP2D6IDO1
SCHEMBL3391301 0.83 POLB (0.69) GPR35POLBLDHACYP2D6IDO1
SCHEMBL9938080 0.81 GPR35 (0.62) GPR35POLBLDHACYP2D6IDO1
SCHEMBL950007 0.81 MEN1 (0.55) GPR35POLBLDHACYP2D6IDO1
SCHEMBL30390267 0.81 IDO1 (0.53) GPR35POLBLDHACYP2D6IDO1
SCHEMBL6036589 0.81 IDO1 (0.53) GPR35POLBLDHACYP2D6IDO1
SCHEMBL22857662 0.81 IDO1 (0.53) GPR35POLBLDHACYP2D6IDO1
SCHEMBL950921 0.81 IDO1 (0.53) GPR35POLBLDHACYP2D6IDO1

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
US-20060022177-A1 Nanoparticulate organc uv absorber BASF AKTIENGESELLSCHAFT (DE) 2006-02-02 US disclosed
CN-1668673-A Nanoparticle organic UV absorbers BASF AG (DE) 2005-09-14 CN disclosed
EP-1499659-A1 NANOPARTICULATE ORGANIC UV ABSORBER BASF AKTIENGESELLSCHAFT (DE) 2005-01-26 EP disclosed
WO-2003085033-A1 NANOPARTICULATE ORGANIC UV ABSORBER BASF AKTIENGESELLSCHAFT (DE) 2003-10-16 WO disclosed