SCHEMBL6680150

SCHEMBL6680150

CCCCCCCCOc1ccc(-c2nc(-c3ccc(C(C)(C)C)cc3)nc(-c3ccc(C(C)(C)C)cc3)n2)c(OC(C)=O)c1

nearest known ligand 0.46

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PTPN11 Q06124 4/20 0.46
RARB P10826 3/20 0.42
NFKB1 P19838 1/20 0.39
NFKB2 Q00653 1/20 0.39
RELA Q04206 1/20 0.39
NPC1 O15118 1/20 0.39
LMNA P02545 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
TP53 P04637 1/20 0.39
TSHR P16473 1/20 0.39
ACACB O00763 1/20 0.39
PLA2G4B P0C869 1/20 0.39
PDK2 Q15119 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
SCHEMBL7755968 0.93 PTPN11 (0.44) PTPN11RARBNFKB1NFKB2RELA
SCHEMBL6676195 0.91 PTPN11 (0.37) PTPN11RARBNFKB1NFKB2RELA
SCHEMBL6681424 0.88 PTPN11 (0.53) PTPN11RARBLMNATP53TSHR
SCHEMBL6681432 0.84 PTPN11 (0.46) PTPN11RARBNPC1PDK2
SCHEMBL5546811 0.84 PTPN11 (0.46) PTPN11RARBNPC1PDK2
SCHEMBL19484788 0.83 MAPT (0.43) PTPN11NFKB1NFKB2RELANPC1
SCHEMBL7760968 0.77 PTPN11 (0.44) PTPN11RARBNPC1PDK2
SCHEMBL5546824 0.75 CNR2 (0.54) PTPN11
SCHEMBL5546820 0.74 CYP3A4 (0.47) PTPN11RARBNPC1SMN1; SMN2
SCHEMBL22017469 0.73 POLB (0.41) PTPN11NFKB1NFKB2RELANPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1089984-B1 NON-YELLOWING PARA-TERTIARY-ALKYL PHENYL SUBSTITUTED TRIAZINE AND PYRIMIDINE ULTRAVIOLET LIGHT ABSORBERS CYTEC TECH CORP (US) 2004-10-27 EP disclosed
US-6509399-B2 Radiation resistance; absorber CYTEC TECHNOLOGY CORP 2003-01-21 US disclosed
US-20020013462-A1 Non-yellowing part-tertiary-alkyl phenyl substituted triazine and pyrimidine ultraviolet light absorbers CYTEC INDUSTRIES CORP. 2002-01-31 US disclosed
US-20010031867-A1 Non-yellowing para-tertiary-alkyl phenyl substituted triazineand pyrimidine ultraviolet light absorbers CYTEC INDUSTRIES CORP. 2001-10-18 US disclosed
US-6239276-B1 STABILIZER CYTEC TECHNOLOGY CORPORATION 2001-05-29 US 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

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20010031867-A1 Non-yellowing para-tertiary-alkyl phenyl substituted triazineand pyrimidine ultraviolet light absorbers TERB1, RAD52, ERCC4 PTPN11 333/4885RARB 437/4885NFKB1 2792/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.