SCHEMBL2947274

SCHEMBL2947274

CCCCCCc1cc(Br)ccc1-c1ccc(Br)cc1CCCCCC

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TYR P14679 2/20 0.44
TP53 P04637 2/20 0.44
CYP3A4 P08684 2/20 0.44
MEN1 O00255 1/20 0.44
ALOX5 P09917 1/20 0.44
MAPT P10636 1/20 0.44
ALOX15 P16050 1/20 0.44
TSHR P16473 1/20 0.44
HTT P42858 1/20 0.44
KMT2A Q03164 1/20 0.44
TDP1 Q9NUW8 1/20 0.44
LIPG Q9Y5X9 1/20 0.42
GPR3 P46089 1/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
NPC1 O15118 1/20 0.41
GAA P10253 1/20 0.41
NFKB1 P19838 1/20 0.41
RAB9A P51151 1/20 0.41
NFKB2 Q00653 1/20 0.41
RELA Q04206 1/20 0.41

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
SCHEMBL19846950 1.00 TYR (0.44) TYRTP53CYP3A4MEN1ALOX5
SCHEMBL5180184 1.00 TYR (0.44) TYRTP53CYP3A4MEN1ALOX5
SCHEMBL5180165 0.90 TYR (0.40) TYRTP53CYP3A4MEN1ALOX5
SCHEMBL12798312 0.90 TYR (0.40) TYRTP53CYP3A4MEN1ALOX5
SCHEMBL8780368 0.87 LIPG (0.42) TYRTP53CYP3A4MEN1ALOX5
SCHEMBL27878175 0.86 TYR (0.50) TYRTP53CYP3A4MEN1ALOX5
SCHEMBL27827947 0.86 TYR (0.50) TYRTP53CYP3A4MEN1ALOX5
SCHEMBL15478240 0.86 RARB (0.41) TYRTP53CYP3A4MEN1ALOX5
SCHEMBL27574849 0.85 TYR (0.44) TYRTP53CYP3A4MEN1ALOX5
SCHEMBL18265434 0.85 TYR (0.53) TYRTP53CYP3A4MEN1ALOX5

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-8653508-B2 Conjugated polymer, insolubilized polymer, organic electroluminescence element material, composition for organic electroluminescence element, polymer production process, organic electroluminescence element, organic EL display and organic EL lighting MITSUBISHI CHEMICAL CORPORATION (JP) 2014-02-18 US disclosed
US-7750112-B2 Polymers comprising benzotriazole for use in optical devices CIBA SPECIALTY CHEMICALS CORP. (US) 2010-07-06 US disclosed
US-20070043204-A1 Novel polymers comprising benzotriazole for use in optical devices CIBA SPECIALITY CHEMICALS CORP. 2007-02-22 US disclosed