SCHEMBL3360341

SCHEMBL3360341

CCCCC(CC)COc1ccc(-c2nc(-c3ccc(OCC(CC)CCCC)c(C)c3O)nc(-n3cc(-c4ccc(OC)cc4)cn3)n2)c(O)c1C

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 0.38
MEN1 O00255 5/20 0.38
KMT2A Q03164 5/20 0.38
KDM4E B2RXH2 4/20 0.38
TDP1 Q9NUW8 3/20 0.38
NPSR1 Q6W5P4 2/20 0.38
LMNA P02545 1/20 0.38
ALOX12 P18054 1/20 0.38
ADORA2A P29274 3/20 0.36
ADORA3 P0DMS8 3/20 0.36
ADORA1 P30542 2/20 0.36
MAPKAPK2 P49137 1/20 0.35
ALDH1A1 P00352 3/20 0.34
GAA P10253 1/20 0.34
ALOX15 P16050 1/20 0.34
TSHR P16473 1/20 0.34
MAPK1 P28482 1/20 0.34
ALKBH1 Q13686 3/20 0.33
SMN1; SMN2 Q16637 2/20 0.33
HPGD P15428 2/20 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
SCHEMBL3361360 0.81 MEN1 (0.33) MEN1KMT2ATDP1CRHR1
SCHEMBL3469120 0.80 PRKD3 (0.33) MAPTMEN1KMT2AKDM4ETDP1
SCHEMBL3360996 0.80 ALDH1A1 (0.34) MAPTMEN1KMT2AKDM4ETDP1
SCHEMBL3363604 0.78 LMNA (0.34) MAPTMEN1KMT2AKDM4ETDP1
SCHEMBL3359285 0.78 MAPKAPK2 (0.46) MAPTMEN1KMT2AKDM4ETDP1
SCHEMBL3468921 0.77 ABCC2 (0.37) KDM4ECRHR1
SCHEMBL3359268 0.77 CRHR1 (0.34) KDM4ETDP1CRHR1
SCHEMBL3469068 0.77 CRHR1 (0.34) KDM4ETDP1CRHR1
SCHEMBL3469122 0.76 PDE10A (0.33) LMNAALDH1A1MAPK1
SCHEMBL3475364 0.76 ADAM17 (0.34) TDP1CRHR1

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
WO-2010081835-A2 BIS-RESORCINYL-TRIAZINE DERIVATIVES AS PROTECTING AGENTS AGAINST UV RADIATION ISDIN, S. A. (ES) 2010-07-22 WO claimed
EP-2210887-A1 Bis resorcinyl triazine derivatives as protecting agents against UV radiation ISDIN, S.A. (ES) 2010-07-28 EP disclosed
WO-2010081835-A2 BIS-RESORCINYL-TRIAZINE DERIVATIVES AS PROTECTING AGENTS AGAINST UV RADIATION ISDIN, S. A. (ES) 2010-07-22 WO disclosed