SCHEMBL13282975

SCHEMBL13282975

Cc1cn(-c2nc(-c3ccc(C)c(C)c3O)nc(-c3ccc(O)c(C)c3O)n2)nc1-c1ccccc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 10/20 0.41
GAA P10253 5/20 0.41
TDP1 Q9NUW8 4/20 0.41
ALOX15 P16050 2/20 0.41
TSHR P16473 2/20 0.41
MAPK1 P28482 2/20 0.41
USP2 O75604 2/20 0.41
TP53 P04637 1/20 0.41
HSD17B10 Q99714 1/20 0.41
KMT2A Q03164 8/20 0.37
KDM4E B2RXH2 7/20 0.37
MEN1 O00255 7/20 0.37
LMNA P02545 5/20 0.37
CNR1 P21554 1/20 0.37
GPR55 Q9Y2T6 1/20 0.37
BCHE P06276 1/20 0.32
ACHE P22303 1/20 0.32
ALOX12 P18054 2/20 0.31
ALDH1A1 P00352 2/20 0.31
NPSR1 Q6W5P4 4/20 0.31

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
SCHEMBL3360990 0.96 MAPT (0.43) MAPTGAATDP1ALOX15TSHR
SCHEMBL13270938 0.95 MAPT (0.34) MAPTGAATDP1ALOX15TSHR
SCHEMBL13271093 0.76 MAPT (0.36) MAPTGAATDP1ALOX15TSHR
SCHEMBL3696821 0.71 ESR1 (0.44) MAPTGAATDP1ALOX15TSHR
SCHEMBL13030469 0.71 MAPT (0.38) MAPTTDP1ALOX15TSHRMAPK1
SCHEMBL30772116 0.71 ESR1 (0.44) MAPTGAATDP1ALOX15TSHR
SCHEMBL30772115 0.71 ESR1 (0.44) MAPTGAATDP1ALOX15TSHR
SCHEMBL3360860 0.70 MAPT (0.39) MAPTGAATDP1ALOX15TSHR
SCHEMBL13282958 0.70 USP2 (0.39) MAPTGAATDP1ALOX15TSHR
SCHEMBL3360311 0.69 KDM4E (0.43) MAPTGAATDP1TSHRMAPK1

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-2010081835-A2 BIS-RESORCINYL-TRIAZINE DERIVATIVES AS PROTECTING AGENTS AGAINST UV RADIATION ISDIN, S. A. (ES) 2010-07-22 WO disclosed