SCHEMBL3783459

SCHEMBL3783459

Cc1cc(C(C)(C)C)cc(C)c1N(c1ccccc1)c1ccc(Br)cc1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP2D6 P10635 2/20 0.36
ALDH1A1 P00352 4/20 0.33
TDP1 Q9NUW8 2/20 0.33
L3MBTL1 Q9Y468 2/20 0.33
CYP1A2 P05177 2/20 0.33
CYP3A4 P08684 2/20 0.33
CYP2C9 P11712 2/20 0.33
CYP2C19 P33261 2/20 0.33
KDM4E B2RXH2 1/20 0.33
MAPT P10636 1/20 0.33
POLB P06746 1/20 0.33
MEN1 O00255 4/20 0.33
KMT2A Q03164 4/20 0.33
MAPK1 P28482 1/20 0.32
HTR1D P28221 1/20 0.32
HTR1B P28222 1/20 0.32
TSHR P16473 2/20 0.32
HTT P42858 1/20 0.32
RAB9A P51151 1/20 0.32
NPSR1 Q6W5P4 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
SCHEMBL4326685 1.00 CYP2D6 (0.36) CYP2D6ALDH1A1TDP1L3MBTL1CYP1A2
SCHEMBL46864 0.93 POLB (0.38) CYP2D6ALDH1A1CYP1A2CYP2C9CYP2C19
SCHEMBL3057784 0.93 POLB (0.38) CYP2D6ALDH1A1CYP1A2CYP2C9CYP2C19
SCHEMBL1087477 0.91 CYP2D6 (0.40) CYP2D6ALDH1A1TDP1L3MBTL1CYP1A2
SCHEMBL3768700 0.89 CYP2D6 (0.41) CYP2D6ALDH1A1TDP1L3MBTL1CYP1A2
SCHEMBL12440938 0.88 ALDH1A1 (0.45) ALDH1A1CYP1A2CYP3A4CYP2C19MAPT
SCHEMBL15854822 0.88 RXRB (0.35) ALDH1A1POLBMAPK1HTR1DRAB9A
SCHEMBL13174556 0.88 ALDH1A1 (0.45) ALDH1A1CYP1A2CYP3A4CYP2C19MAPT
SCHEMBL1116041 0.88 RAPGEF4 (0.40) ALDH1A1POLBHTR1DTSHRRXRB
SCHEMBL1087423 0.88 RXRB (0.35) ALDH1A1POLBMAPK1HTR1DRAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1892256-B1 AROMATIC POLYMER SUMITOMO CHEMICAL CO (JP) 2014-03-19 EP disclosed
US-7852434-B2 Aromatic polymer SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2010-12-14 US disclosed
US-7852434-B2 Aromatic polymer SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2010-12-14 US disclosed
US-7852434-B2 Aromatic polymer SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2010-12-14 US disclosed
US-20090207346-A1 Aromatic polymer SUMITOMO CHEMICAL COMPANY,LIMITED (JP) 2009-08-20 US disclosed
US-20090207346-A1 Aromatic polymer SUMITOMO CHEMICAL COMPANY,LIMITED (JP) 2009-08-20 US disclosed
US-20090209715-A1 Process for producing polymer SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2009-08-20 US disclosed
US-20090207346-A1 Aromatic polymer SUMITOMO CHEMICAL COMPANY,LIMITED (JP) 2009-08-20 US disclosed
US-20090209715-A1 Process for producing polymer SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2009-08-20 US disclosed
US-20090209715-A1 Process for producing polymer SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2009-08-20 US disclosed
US-20090099391-A1 Novel Aryl Compound SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2009-04-16 US disclosed
US-20090096355-A1 Aromatic Graft Polymer SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2009-04-16 US disclosed
US-20090096355-A1 Aromatic Graft Polymer SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2009-04-16 US disclosed
US-20090096355-A1 Aromatic Graft Polymer SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2009-04-16 US disclosed
US-20090099391-A1 Novel Aryl Compound SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2009-04-16 US disclosed
EP-1892257-A1 AROMATIC GRAFT POLYMER Sumitomo Chemical Company, Limited (JP) 2008-02-27 EP disclosed
EP-1892234-A1 NOVEL ARYL COMPOUND Sumitomo Chemical Company, Limited (JP) 2008-02-27 EP disclosed
EP-1892256-A1 AROMATIC POLYMER Sumitomo Chemical Company, Limited (JP) 2008-02-27 EP disclosed
EP-1892258-A1 PROCESS FOR PRODUCING POLYMER Sumitomo Chemical Company, Limited (JP) 2008-02-27 EP 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-20090099391-A1 Novel Aryl Compound BAZ2B, AHR, BAZ2A CYP2D6 840/4885ALDH1A1 1206/4885TDP1 4752/4885

“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.