SCHEMBL6860672

SCHEMBL6860672

COc1ccc(C(C)(C)c2cc(CCC(=O)OCCOCCOCCOCCOCCOCCOCCOCCOC(=O)CCc3cc(-n4nc5ccccc5n4)c(O)c(C(C)(C)c4ccc(OC)cc4)c3)cc(-n3nc4ccccc4n3)c2O)cc1

nearest known ligand 0.40

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 1/20 0.40
MAPT P10636 3/20 0.37
ALDH1A1 P00352 2/20 0.37
TDP1 Q9NUW8 2/20 0.37
NPC1 O15118 3/20 0.36
RAB9A P51151 3/20 0.36
KMT2A Q03164 1/20 0.36
HTT P42858 1/20 0.34
CHRM5 P08912 1/20 0.34
CHRM1 P11229 1/20 0.34
CHRM3 P20309 1/20 0.34
HPGD P15428 1/20 0.33
GAA P10253 1/20 0.33
KDM4E B2RXH2 1/20 0.33
POLB P06746 1/20 0.33
NTRK1 P04629 1/20 0.33
TP53 P04637 1/20 0.32
LMNA P02545 1/20 0.32
L3MBTL1 Q9Y468 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
SCHEMBL6864209 0.91 KDM4E (0.39) MAPTALDH1A1TDP1NPC1RAB9A
SCHEMBL16623979 0.86 ALOX5 (0.42) ALOX5ALDH1A1TDP1NPC1RAB9A
SCHEMBL100357 0.86 ALOX5 (0.42) ALOX5ALDH1A1TDP1NPC1RAB9A
SCHEMBL100778 0.84 ALOX5 (0.41) ALOX5ALDH1A1TDP1NPC1RAB9A
SCHEMBL3413677 0.84 ALOX5 (0.41) ALOX5ALDH1A1TDP1NPC1RAB9A
SCHEMBL7522007 0.84 ALOX5 (0.41) ALOX5MAPTALDH1A1TDP1NPC1
SCHEMBL3287819 0.84 ALOX5 (0.41) ALOX5ALDH1A1TDP1NPC1RAB9A
SCHEMBL101256 0.84 ALOX5 (0.41) ALOX5ALDH1A1TDP1NPC1RAB9A
SCHEMBL14413560 0.84 ALOX5 (0.43) ALOX5ALDH1A1TDP1NPC1RAB9A
SCHEMBL10135978 0.83 ALOX5 (0.44) ALOX5ALDH1A1TDP1NPC1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6800676-B2 ULTRAVIOLET RADIATION ABSORBERS; HEAT AND OXIDATION RESISTANCE CIBA SPECIALTY CHEMICALS CORPORATION 2004-10-05 US disclosed
US-20030004235-A1 Benzotriazoles containing phenyl groups substituted by heteroatoms and compositions stabilized therewith CIBA SPECIALTY CHEMICALS CORP. 2003-01-02 US disclosed
US-6451887-B1 Benzotriazoles containing α-cumyl groups substituted by heteroatoms and compositions stabilized therewith CIBA SPECIALTY CHEMICALS CORPORATION 2002-09-17 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-20030004235-A1 Benzotriazoles containing phenyl groups substituted by heteroatoms and compositions stabilized therewith SUV39H1, SUV39H2, TPST2 ALOX5 2311/4885MAPT 119/4885ALDH1A1 831/4885

“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.