SCHEMBL992052

SCHEMBL992052

CCCCCCCCc1cc2c(cc1CCCCCCCC)c1cc(Br)sc1c1sc(Br)cc21

nearest known ligand 0.38

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
GPR35 Q9HC97 5/20 0.38
ALOX5 P09917 4/20 0.37
MEN1 O00255 1/20 0.37
TP53 P04637 1/20 0.37
CYP3A4 P08684 1/20 0.37
MAPT P10636 1/20 0.37
TYR P14679 1/20 0.37
ALOX15 P16050 1/20 0.37
TSHR P16473 1/20 0.37
HTT P42858 1/20 0.37
KMT2A Q03164 1/20 0.37
TDP1 Q9NUW8 1/20 0.37
LIPG Q9Y5X9 1/20 0.34
PTGS2 P35354 5/20 0.33
TLR8 Q9NR97 3/20 0.33

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
SCHEMBL17385662 0.90 GPR35 (0.38) GPR35ALOX5MEN1TP53CYP3A4
SCHEMBL17385649 0.90 GPR35 (0.38) GPR35ALOX5MEN1TP53CYP3A4
SCHEMBL17385793 0.90 GPR35 (0.38) GPR35ALOX5MEN1TP53CYP3A4
SCHEMBL2679142 0.83 GPR35 (0.43) GPR35ALOX5PTGS2TLR8
SCHEMBL991738 0.83 GPR35 (0.43) GPR35ALOX5PTGS2TLR8
SCHEMBL15979452 0.81 GPR35 (0.38) GPR35ALOX5MEN1TP53CYP3A4
SCHEMBL15977970 0.81 GPR35 (0.38) GPR35ALOX5MEN1TP53CYP3A4
SCHEMBL3371736 0.81 GPR35 (0.41) GPR35ALOX5CYP3A4HTTPTGS2
SCHEMBL14706992 0.79 GPR35 (0.43) GPR35ALOX5PTGS2
SCHEMBL337083 0.79 GPR35 (0.43) GPR35ALOX5PTGS2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9184390-B2 Polymers with tunable band gaps for photonic and electronic applications THE UNIVERSITY OF NORTH CAROLINA AT CHAPEL HILL (US) 2015-11-10 US disclosed
US-9184390-B2 Polymers with tunable band gaps for photonic and electronic applications THE UNIVERSITY OF NORTH CAROLINA AT CHAPEL HILL (US) 2015-11-10 US disclosed
US-8440785-B2 Compositions, methods and polymers PLEXTRONICS, INC. (US) 2013-05-14 US disclosed
US-20130092912-A1 POLYMERS WITH TUNABLE BAND GAPS FOR PHOTONIC AND ELECTRONIC APPLICATIONS NAVY, SECRETARY OF THE UNITED STATES OF AMERICA 2013-04-18 US disclosed
US-20130092912-A1 POLYMERS WITH TUNABLE BAND GAPS FOR PHOTONIC AND ELECTRONIC APPLICATIONS NAVY, SECRETARY OF THE UNITED STATES OF AMERICA 2013-04-18 US disclosed
US-20110028644-A1 NOVEL COMPOSITIONS, METHODS AND POLYMERS PLEXTRONICS, INC. 2011-02-03 US disclosed
US-20110006287-A1 POLYMERS WITH TUNABLE BAND GAPS FOR PHOTONIC AND ELECTRONIC APPLICATIONS NATIONAL SCIENCE FOUNDATION 2011-01-13 US disclosed
US-20110006287-A1 POLYMERS WITH TUNABLE BAND GAPS FOR PHOTONIC AND ELECTRONIC APPLICATIONS NATIONAL SCIENCE FOUNDATION 2011-01-13 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 (2 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-20130092912-A1 POLYMERS WITH TUNABLE BAND GAPS FOR PHOTONIC AND ELECTRONIC APPLICATIONS GJB2, PARG, PARN GPR35 3920/4885ALOX5 2683/4885MEN1 1102/4885
US-20110006287-A1 POLYMERS WITH TUNABLE BAND GAPS FOR PHOTONIC AND ELECTRONIC APPLICATIONS GJB2, CYBA, MB GPR35 4164/4885ALOX5 2022/4885MEN1 508/4885

“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.