SCHEMBL700152

SCHEMBL700152

Brc1cccc(-c2cccc(-c3cccc(Br)n3)n2)n1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CCR1 P32246 2/20 0.46
CCR8 P51685 2/20 0.46
KDM4E B2RXH2 2/20 0.46
TDP1 Q9NUW8 2/20 0.46
L3MBTL1 Q9Y468 2/20 0.46
LMNA P02545 1/20 0.46
TP53 P04637 1/20 0.46
ALPL P05186 1/20 0.46
HSP90AA1 P07900 1/20 0.46
ALPI P09923 1/20 0.46
ALPG P10696 1/20 0.46
ALOX15 P16050 1/20 0.46
MAPK1 P28482 1/20 0.46
HTT P42858 1/20 0.46
CCR5 P51681 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
MEN1 O00255 2/20 0.43
KMT2A Q03164 2/20 0.43
RAB9A P51151 1/20 0.43
ALDH1A1 P00352 3/20 0.39

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
SCHEMBL31354842 1.00 CCR1 (0.46) CCR1CCR8KDM4ETDP1L3MBTL1
SCHEMBL29539234 0.97 CCR1 (0.46) CCR1CCR8KDM4ETDP1L3MBTL1
SCHEMBL229994 0.97 CCR1 (0.46) CCR1CCR8KDM4ETDP1L3MBTL1
SCHEMBL23598723 0.86 MEN1 (0.70) CCR1CCR8KDM4ETDP1L3MBTL1
SCHEMBL994004 0.84 KDM4E (0.75) CCR1CCR8KDM4ETDP1L3MBTL1
SCHEMBL3419835 0.83 CCR1 (0.73) CCR1CCR8RAB9ATGFBR1MAPK14
SCHEMBL16705267 0.83 CCR1 (0.36) CCR1CCR8KDM4ETDP1L3MBTL1
SCHEMBL16511928 0.83 CYP3A4 (0.40) CCR1CCR8KDM4ETDP1L3MBTL1
SCHEMBL353379 0.81 KDM4E (0.71) CCR1CCR8KDM4ETDP1L3MBTL1
SCHEMBL30485904 0.81 KDM4E (0.71) CCR1CCR8KDM4ETDP1L3MBTL1

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 35 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9573117-B2 Catalyst precursors, catalysts and methods of producing same INSTITUTE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (CA) 2017-02-21 US disclosed
EP-2423752-B1 Electrophotographic photosensitive member, process cartridge, and electrophotographic apparatus CANON KK (JP) 2015-09-23 EP disclosed
US-20150224490-A1 Hydrosilylation Catalysts Made With Terdentate Nitrogen Ligands And Compositions Containing The Catalysts DOW CORNING (US) 2015-08-13 US disclosed
US-20150224490-A1 Hydrosilylation Catalysts Made With Terdentate Nitrogen Ligands And Compositions Containing The Catalysts DOW CORNING (US) 2015-08-13 US disclosed
US-20140228570-A1 Hydrosilylation Catalysts Made With Terdentate Nitrogen Ligands And Compositions Containing The Catalysts DOW CORNING CORPORATION 2014-08-14 US disclosed
US-20140228570-A1 Hydrosilylation Catalysts Made With Terdentate Nitrogen Ligands And Compositions Containing The Catalysts DOW CORNING CORPORATION 2014-08-14 US disclosed
US-20140099571-A1 CATALYSTS MADE USING THERMALLY DECOMPOSABLE POROUS SUPPORTS INSTITUT NATIONAL DE LA RECHERCHE SCIENTIFIQUE (CA) 2014-04-10 US disclosed
EP-2457912-B1 Compound having pyridoindole ring structure having substituted pyridyl group attached thereto, and organic electroluminescence element HODOGAYA CHEMICAL CO LTD (JP) 2013-12-04 EP disclosed
US-8580704-B2 Catalyst precursors, catalysts and methods of producing same INSTITUT NATIONAL DE LA RECHERCHE SCIENTIFIQUE (CA) 2013-11-12 US disclosed
US-8546050-B2 Electrophotographic photosensitive member, process cartridge, and electrophotographic apparatus CANON KABUSHIKI KAISHA (JP) 2013-10-01 US disclosed
US-8022617-B2 Organic compound, charge-transporting material, composition for charge-transporting material and organic electroluminescent device MITSUBISHI CHEMICAL CORPORATION (JP) 2011-09-20 US disclosed
US-20110033776-A1 PROTON EXCHANGE MEMBRANES Board of regents of the Nevada System of Higher Education, on Behalf of the University of 2011-02-10 US disclosed
US-20100230660-A1 COMPOUND HAVING PYRIDOINDOLE RING STRUCTURE HAVING SUBSTITUTED PYRIDYL GROUP ATTACHED THERETO, AND ORGANIC ELECTROLUMINESCENCE ELEMENT HODOGAYA CHEMICAL CO., LTD. (JP) 2010-09-16 US disclosed
US-20090284134-A1 ORGANIC COMPOUND, CHARGE-TRANSPORTING MATERIAL, COMPOSITION FOR CHARGE-TRANSPORTING MATERIAL AND ORGANIC ELECTROLUMINESCENT DEVICE MITSUBISHI CHEMICAL CORPORATION (JP) 2009-11-19 US disclosed
US-20090284134-A1 ORGANIC COMPOUND, CHARGE-TRANSPORTING MATERIAL, COMPOSITION FOR CHARGE-TRANSPORTING MATERIAL AND ORGANIC ELECTROLUMINESCENT DEVICE MITSUBISHI CHEMICAL CORPORATION (JP) 2009-11-19 US disclosed
US-20090284134-A1 ORGANIC COMPOUND, CHARGE-TRANSPORTING MATERIAL, COMPOSITION FOR CHARGE-TRANSPORTING MATERIAL AND ORGANIC ELECTROLUMINESCENT DEVICE MITSUBISHI CHEMICAL CORPORATION (JP) 2009-11-19 US disclosed
EP-2053051-A1 COMPOUND HAVING PYRIDOINDOLE RING STRUCTURE HAVING SUBSTITUTED PYRIDYL GROUP ATTACHED THERETO, AND ORGANIC ELECTROLUMINESCENCE ELEMENT Hodogaya Chemical Co., Ltd. (JP) 2009-04-29 EP disclosed
EP-1956008-A1 ORGANIC COMPOUND, CHARGE-TRANSPORTING MATERIAL, COMPOSITION FOR CHARGE-TRANSPORTING MATERIAL AND ORGANIC ELECTROLUMINESCENT DEVICE Mitsubishi Chemical Corporation (JP) 2008-08-13 EP disclosed
US-5539117-A 2-acetyl-6-cyanopyridines and their use as intermediates in the synthesis of oligo-2,6-pyridines GE HEALTHCARE AS (NO) 1996-07-23 US disclosed
US-5350696-A 2-acetyl-6-cyanopyridines and their use as intermediates in the synthesis of oligo-2,6-pyridines STERLING WINTHROP, INC. (US) 1994-09-27 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 (4 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-20150224490-A1 Hydrosilylation Catalysts Made With Terdentate Nitrogen Ligands And Compositions Containing The Catalysts HIRA, TPR, TST CCR1 614/4885CCR8 977/4885KDM4E 4174/4885
US-20100230660-A1 COMPOUND HAVING PYRIDOINDOLE RING STRUCTURE HAVING SUBSTITUTED PYRIDYL GROUP ATTACHED THERETO, AND ORGANIC ELECTROLUMINESCENCE ELEMENT SCO2, PNPO, WEE1 CCR1 768/4885CCR8 1548/4885KDM4E 690/4885
US-20140228570-A1 Hydrosilylation Catalysts Made With Terdentate Nitrogen Ligands And Compositions Containing The Catalysts HIRA, TPR, TST CCR1 614/4885CCR8 977/4885KDM4E 4174/4885
US-20090284134-A1 ORGANIC COMPOUND, CHARGE-TRANSPORTING MATERIAL, COMPOSITION FOR CHARGE-TRANSPORTING MATERIAL AND ORGANIC ELECTROLUMINESCENT DEVICE SLCO4C1, SLCO2A1, SLCO2B1 CCR1 704/4885CCR8 1811/4885KDM4E 2949/4885

“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.