SCHEMBL9635566

SCHEMBL9635566

CC(C)Oc1ccc(-c2nc(-c3ccccc3)nc(-c3ccccc3)n2)c(O)c1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.48
TSHR P16473 2/20 0.48
ADORA3 P0DMS8 1/20 0.48
ALOX15 P16050 1/20 0.48
ADORA2A P29274 1/20 0.48
ADORA2B P29275 1/20 0.48
ADORA1 P30542 1/20 0.48
RXRA P19793 1/20 0.44
RXRB P28702 1/20 0.44
NPC1 O15118 2/20 0.43
ABCB1 P08183 1/20 0.43
KMT2A Q03164 3/20 0.42
NPSR1 Q6W5P4 1/20 0.42
MCL1 Q07820 3/20 0.41
MEN1 O00255 2/20 0.41
NTSR1 P30989 1/20 0.41
ALDH1A1 P00352 3/20 0.41
POLB P06746 1/20 0.41
GAA P10253 1/20 0.41
PTGS1 P23219 1/20 0.41

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
SCHEMBL31499114 0.97 RXRA (0.49) MAPTTSHRADORA3ALOX15ADORA2A
SCHEMBL8374863 0.93 MCL1 (0.48) MAPTTSHRADORA3ALOX15ADORA2A
SCHEMBL5859402 0.90 TSHR (0.47) MAPTTSHRADORA3ALOX15ADORA2A
SCHEMBL29660560 0.89 NPC1 (0.51) MAPTTSHRNPC1KMT2AMCL1
SCHEMBL995436 0.89 NPC1 (0.51) MAPTTSHRNPC1KMT2AMCL1
SCHEMBL9634510 0.87 MEN1 (0.53) MAPTTSHRADORA3ADORA2AADORA1
SCHEMBL31260210 0.85 CYP1A2 (0.62) MAPTTSHRADORA3ALOX15ADORA2A
SCHEMBL13474410 0.85 CYP1A2 (0.62) MAPTTSHRADORA3ALOX15ADORA2A
SCHEMBL8385594 0.84 KLK7 (0.54) MAPTTSHRADORA3ALOX15ADORA2A
SCHEMBL10034100 0.84 GAA (0.50) MAPTTSHRADORA3ALOX15ADORA2A

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-0280653-B1 PROCESS FOR IMPROVING THE PHOTOCHEMICAL STABILITY OF DYEINGS ON FIBROUS POLYESTER MATERIALS CIBA-GEIGY AG (CH) 1992-05-13 EP disclosed
US-4831068-A PHENYL-S-TRIAZINE DERIVATIVES AS UV ABSORBERS CIBA-GEIGY CORPORATION (US) 1989-05-16 US disclosed