SCHEMBL7760968

SCHEMBL7760968

CCCCCCCCOc1ccc(-c2ncnc(-c3ccc(C(C)(C)C)cc3)n2)c(O)c1

nearest known ligand 0.44

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PTPN11 Q06124 4/20 0.44
NR5A1 Q13285 1/20 0.43
CNR2 P34972 3/20 0.41
CNR1 P21554 1/20 0.41
RARB P10826 3/20 0.40
ALDH2 P05091 1/20 0.40
MEN1 O00255 1/20 0.39
NPC1 O15118 1/20 0.39
ALDH1A1 P00352 1/20 0.39
GAA P10253 1/20 0.39
MAPT P10636 1/20 0.39
RAB9A P51151 1/20 0.39
KMT2A Q03164 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
PDK2 Q15119 1/20 0.39
THRA P10827 1/20 0.39
LTA4H P09960 1/20 0.39

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
SCHEMBL6681432 0.92 PTPN11 (0.46) PTPN11NR5A1CNR2CNR1RARB
SCHEMBL5546811 0.92 PTPN11 (0.46) PTPN11NR5A1CNR2CNR1RARB
SCHEMBL28216762 0.88 PTPN11 (0.46) PTPN11NR5A1CNR2RARBALDH2
SCHEMBL1243172 0.87 NPC1 (0.47) PTPN11NR5A1RARBMEN1NPC1
SCHEMBL8218511 0.87 NR5A1 (0.55) PTPN11NR5A1CNR2MEN1NPC1
SCHEMBL5350137 0.87 PTPN11 (0.49) PTPN11NR5A1RARBALDH2NPC1
SCHEMBL29051494 0.86 PTPN11 (0.51) PTPN11NR5A1RARBGAAPDK2
SCHEMBL29693771 0.86 PTPN11 (0.51) PTPN11NR5A1RARBGAAPDK2
SCHEMBL7755968 0.85 PTPN11 (0.44) PTPN11RARBNPC1ALDH1A1RAB9A
SCHEMBL28859654 0.84 NPC1 (0.44) PTPN11NR5A1MEN1NPC1ALDH1A1

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
CN-1203065-C Non-yellowing para-tertiary-alkyl phenyl substituted triazine and pyrimidine ultraviolet light absorbers CYTEC TECH CORP (US) 2005-05-25 CN disclosed
CN-1306520-A Non-yellowing para-tertiary-alkyl phenyl substituted triazine and pyrimidine ultraviolet light absorbers CYTEC TECH CORP (US) 2001-08-01 CN disclosed
EP-1089984-A1 NON-YELLOWING PARA-TERTIARY-ALKYL PHENYL SUBSTITUTED TRIAZINE AND PYRIMIDINE ULTRAVIOLET LIGHT ABSORBERS CYTEC TECHNOLOGY CORP. (US) 2001-04-11 EP disclosed
WO-1999067226-A1 NON-YELLOWING PARA-TERTIARY-ALKYL PHENYL SUBSTITUTED TRIAZINE AND PYRIMIDINE ULTRAVIOLET LIGHT ABSORBERS CYTEC TECHNOLOGY CORP. (US) 1999-12-29 WO disclosed