SCHEMBL1109016

SCHEMBL1109016

Nc1ccc(-c2c(O)c(=O)c2=O)cc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 3/20 0.43
TDP1 Q9NUW8 3/20 0.43
ALDH1A1 P00352 2/20 0.43
TP53 P04637 1/20 0.43
HSD17B10 Q99714 2/20 0.40
CA14 Q9ULX7 2/20 0.40
CA3 P07451 1/20 0.40
THRB P10828 1/20 0.40
ALOX15 P16050 1/20 0.40
CA6 P23280 1/20 0.40
CASP1 P29466 1/20 0.40
HIF1A Q16665 1/20 0.40
LCK P06239 4/20 0.38
APP P05067 2/20 0.38
TAAR1 Q96RJ0 1/20 0.37
MAPT P10636 2/20 0.36
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
CA12 O43570 2/20 0.35
CA9 Q16790 2/20 0.35

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
SCHEMBL4584577 0.83 CYP3A4 (0.56) CYP3A4TDP1ALDH1A1TP53HSD17B10
SCHEMBL12432628 0.77 ALOX12 (0.42) TDP1ALDH1A1TP53HSD17B10ALOX15
SCHEMBL2202541 0.77 SERPINE1 (0.42) ALDH1A1HSD17B10MAPTKDM4EACHE
SCHEMBL2203880 0.76 MAPT (0.59) CYP3A4TP53ALOX15MAPTMEN1
SCHEMBL13290009 0.76 SERPINE1 (0.41) ALDH1A1HSD17B10MAPTKDM4EACHE
SCHEMBL12432447 0.74 MAPT (0.56) CYP3A4TP53ALOX15MAPTMEN1
SCHEMBL3671202 0.72 HDAC4 (0.56) CYP3A4ALDH1A1TP53HSD17B10CA14
SCHEMBL61415 0.72 ALDH1A1 (0.44) ALDH1A1TP53HSD17B10ALOX15HIF1A
SCHEMBL916402 0.72 ALDH1A1 (0.44) TDP1ALDH1A1TP53MAPTMEN1
SCHEMBL28352365 0.71 TDP1 (0.48) CYP3A4TDP1ALDH1A1TP53HSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8153440-B2 Methods for altering surface characteristics of microspheres LUMINEX CORPORATION (US) 2012-04-10 US disclosed
US-20110086431-A1 Methods for Altering Surface Characteristics of Microspheres LUMINEX CORPORATION (US) 2011-04-14 US disclosed
US-7867774-B2 Methods for altering surface characteristics of microspheres LUMINEX CORPORATION (US) 2011-01-11 US disclosed