SCHEMBL3360852

SCHEMBL3360852

Clc1nc(Cl)nc(-n2cccn2)n1

nearest known ligand 0.56

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ADORA2A P29274 14/20 0.56
HTT P42858 2/20 0.49
LMNA P02545 2/20 0.49
ADORA3 P0DMS8 1/20 0.49
ADORA2B P29275 1/20 0.49
ADORA1 P30542 1/20 0.49
NOTUM Q6P988 1/20 0.48
KDM4E B2RXH2 2/20 0.45
ALDH1A1 P00352 2/20 0.45
MAPT P10636 2/20 0.44
MAPK1 P28482 2/20 0.44
NPSR1 Q6W5P4 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
MEN1 O00255 1/20 0.41
GAA P10253 1/20 0.41
G6PD P11413 1/20 0.41
KMT2A Q03164 1/20 0.41
NPC1 O15118 1/20 0.40

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
SCHEMBL28870957 0.84 HTT (0.62) ADORA2AHTTLMNAADORA3ADORA2B
SCHEMBL21144033 0.81 ADORA2A (0.54) ADORA2AHTTLMNAADORA3ADORA2B
SCHEMBL26675098 0.78 BIRC5 (0.46) ADORA2AHTTLMNAADORA3ADORA2B
SCHEMBL28186628 0.74 ALDH1A1 (0.55) ADORA2AHTTLMNAADORA3ADORA2B
SCHEMBL17476686 0.74 KDM4E (0.48) ADORA2AHTTLMNAADORA3ADORA2B
SCHEMBL12280740 0.74 ADORA2A (0.59) ADORA2AHTTLMNAADORA3ADORA2B
SCHEMBL13148426 0.74 ADORA2A (0.55) ADORA2AHTTLMNAADORA3ADORA2B
SCHEMBL30487821 0.74 ADORA2A (0.71) ADORA2AHTTLMNAADORA3ADORA2B
SCHEMBL2551552 0.74 ADORA2A (0.71) ADORA2AHTTLMNAADORA3ADORA2B
SCHEMBL2549963 0.74 ADORA2A (0.71) ADORA2AHTTLMNAADORA3ADORA2B

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
EP-2210887-A1 Bis resorcinyl triazine derivatives as protecting agents against UV radiation ISDIN, S.A. (ES) 2010-07-28 EP disclosed
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