SCHEMBL6659700

SCHEMBL6659700

O=C(O)C1(C(=O)O)C=CC(Nc2ccccc2)=CC1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CASP3 P42574 1/20 0.37
SENP7 Q9BQF6 1/20 0.37
MAPK13 O15264 1/20 0.36
MAPK12 P53778 1/20 0.36
MAPK11 Q15759 1/20 0.36
MAPK14 Q16539 1/20 0.36
MAPT P10636 10/20 0.35
GAA P10253 4/20 0.35
GFER P55789 3/20 0.35
POLB P06746 1/20 0.35
MEN1 O00255 6/20 0.35
KMT2A Q03164 6/20 0.35
HSD17B10 Q99714 2/20 0.34
HCAR3 P49019 1/20 0.34
ALDH1A1 P00352 6/20 0.33
SMN1; SMN2 Q16637 3/20 0.33
TSHR P16473 2/20 0.33
TP53 P04637 2/20 0.33
MAPK1 P28482 2/20 0.33
EPHX1 P07099 1/20 0.33

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
Bicarbonate SCHEMBL30050775 0.73 L3MBTL1 (0.39) MAPTGAAGFERPOLBMEN1
SCHEMBL27936506 0.72 POLB (0.37) MAPTGAAGFERPOLBMEN1
SCHEMBL28154609 0.72 MAPT (0.33) MAPTGAAPOLBMEN1KMT2A
Carbamic Acid SCHEMBL30354461 0.71 L3MBTL1 (0.37) MAPTGAAGFERPOLBMEN1
SCHEMBL332453 0.71 PARP10 (0.35) MAPTMEN1KMT2ASMN1; SMN2TSHR
SCHEMBL30539491 0.71 HSD17B10 (0.34) MAPTGAAGFERPOLBMEN1
SCHEMBL27694870 0.71 HSD17B10 (0.31) HSD17B10ALDH1A1TSHRMAPK1ALOX15
SCHEMBL22401561 0.71 HSD17B10 (0.31) HSD17B10ALDH1A1TSHRMAPK1ALOX15
SCHEMBL28256376 0.70 THRB (0.32) TP53TDP1
SCHEMBL30437979 0.70 HSD17B10 (0.33) HSD17B10ALDH1A1TSHRMAPK1ALOX15

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
EP-1436122-A1 COATED SUBSTRATE WITH ENERGY CURABLE CYANATE RESIN 3M Innovative Properties Company (US) 2004-07-14 EP disclosed
WO-2003033212-A1 COATED SUBSTRATE WITH ENERGY CURABLE CYANATE RESIN 3M INNOVATIVE PROPERTIES COMPANY (US) 2003-04-24 WO disclosed