SCHEMBL7522007

SCHEMBL7522007

CC(c1ccccc1)(c1ccccc1)c1cc(CCC(=O)OCCOCCOCCOCCOCCOCCOCCOCCOC(=O)CCc2cc(-n3nc4ccccc4n3)c(O)c(C(C)(c3ccccc3)c3ccccc3)c2)cc(-n2nc3ccccc3n2)c1O

nearest known ligand 0.41

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 1/20 0.41
TDP1 Q9NUW8 2/20 0.39
APP P05067 2/20 0.36
NPC1 O15118 3/20 0.35
RAB9A P51151 3/20 0.35
KMT2A Q03164 1/20 0.35
KDM4E B2RXH2 2/20 0.34
ALDH1A1 P00352 2/20 0.34
MAPT P10636 1/20 0.34
HPGD P15428 1/20 0.34
MAOB P27338 3/20 0.33
POLB P06746 2/20 0.33
MAOA P21397 2/20 0.33
NTRK1 P04629 1/20 0.33
PPARG P37231 1/20 0.33
PPARA Q07869 1/20 0.33
ACHE P22303 1/20 0.32
GAA P10253 1/20 0.32

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
SCHEMBL16623979 0.90 ALOX5 (0.42) ALOX5TDP1APPNPC1RAB9A
SCHEMBL100357 0.90 ALOX5 (0.42) ALOX5TDP1APPNPC1RAB9A
SCHEMBL7527995 0.89 KDM4E (0.41) ALOX5TDP1NPC1RAB9AKMT2A
SCHEMBL14413560 0.88 ALOX5 (0.43) ALOX5TDP1APPNPC1RAB9A
SCHEMBL7692453 0.87 NPC1 (0.38) NPC1RAB9AKMT2AALDH1A1MAOB
SCHEMBL10135978 0.87 ALOX5 (0.44) ALOX5TDP1APPNPC1RAB9A
SCHEMBL2549825 0.86 ALOX5 (0.39) ALOX5TDP1APPNPC1RAB9A
SCHEMBL100778 0.86 ALOX5 (0.41) ALOX5TDP1APPNPC1RAB9A
SCHEMBL101242 0.86 ALOX5 (0.39) ALOX5TDP1APPNPC1RAB9A
SCHEMBL3287819 0.86 ALOX5 (0.41) ALOX5TDP1APPNPC1RAB9A

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
US-6489383-B1 SUCH AS 2-(2-HYDROXY-3-(1,1-DI(4-2-(BROMOETHOXY)PHENYL) ETHYL)-5-TERT-BUTYLPHENYL)-2H-BENZOTRIAZOLE FOR USE AS STOVING LACQUER, FINISHING ENAMEL FOR AUTOMOBILES CIBA SPECIALTY CHEMICALS CORPORATION 2002-12-03 US disclosed
US-20020169239-A1 2H-benzotriazole UV absorbers substituted with 1,1-diphenylakyl groups and compositions stabilized therewith WOOD MERVIN G (US) 2002-11-14 US 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-20020169239-A1 2H-benzotriazole UV absorbers substituted with 1,1-diphenylakyl groups and compositions stabilized therewith SUV39H1, SUV39H2, PAH ALOX5 2975/4885TDP1 203/4885APP 2267/4885

“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.