SCHEMBL8961783

SCHEMBL8961783

CSc1nc(-c2ccc(C)cc2C)nc(-c2ccc(C)cc2C)n1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSP90AA1 P07900 3/20 0.50
MAPK1 P28482 1/20 0.47
HSP90AB1 P08238 6/20 0.46
NPC1 O15118 4/20 0.41
RAB9A P51151 4/20 0.41
HTT P42858 2/20 0.41
CYP1A2 P05177 2/20 0.41
LMNA P02545 1/20 0.41
PTBP1 P26599 1/20 0.41
CYP2C19 P33261 1/20 0.41
TNFSF10 P50591 1/20 0.41
MAPT P10636 5/20 0.40
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
SMN1; SMN2 Q16637 3/20 0.36
TP53 P04637 1/20 0.36
GAA P10253 1/20 0.36
KDM4E B2RXH2 1/20 0.36
ALDH1A1 P00352 1/20 0.36
HPGD P15428 1/20 0.36

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
SCHEMBL1245257 0.86 NPC1 (0.47) NPC1RAB9ACYP1A2LMNAMAPT
SCHEMBL29354045 0.86 NPC1 (0.47) NPC1RAB9ACYP1A2LMNAMAPT
SCHEMBL16019276 0.80 NPC1 (0.44) NPC1RAB9ACYP1A2LMNAMAPT
SCHEMBL1245251 0.77 NPC1 (0.41) MAPK1NPC1RAB9ACYP1A2LMNA
SCHEMBL22207363 0.77 TP53 (0.45) NPC1RAB9ACYP1A2LMNAMAPT
SCHEMBL6842063 0.77 NPC1 (0.41) MAPK1NPC1RAB9ACYP1A2LMNA
SCHEMBL15894216 0.77 RAB9A (0.49) MAPK1NPC1RAB9ACYP1A2LMNA
SCHEMBL22207162 0.77 RAB9A (0.47) HSP90AA1HSP90AB1NPC1RAB9AHTT
SCHEMBL19901679 0.77 NPC1 (0.49) MAPK1NPC1RAB9ACYP1A2MAPT
SCHEMBL29974237 0.77 NPC1 (0.41) MAPK1NPC1RAB9ACYP1A2LMNA

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0395938-B1 Process for the preparation of 2-(2',4'-dihydroxyphenyl)-4,6-diaryl-s-triazines CIBA GEIGY AG (CH) 1996-01-17 EP disclosed
US-5106972-A 2-METHYL-THIO-4,6-DIARYL-TRIAZINES CIBA-GEIGY CORPORATION (US) 1992-04-21 US disclosed
US-5084570-A PROCESS FOR THE PREPARATION OF 2-(2',4'-DIHYDROXYPHENYL)-4,6-DIARYL-S-TRIAZINES CIBA-GEIGY CORPORATION (US) 1992-01-28 US disclosed
EP-0395938-A2 Process for the preparation of 2-(2',4'-dihydroxyphenyl)-4,6-diaryl-s-triazines CIBA-GEIGY AG (CH) 1990-11-07 EP disclosed