SCHEMBL4909919

SCHEMBL4909919

Ic1ccc(-c2ccccn2)cc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 6/20 0.56
LMNA P02545 3/20 0.56
CYP1A2 P05177 2/20 0.56
CCR1 P32246 2/20 0.56
CCR5 P51681 2/20 0.56
CCR8 P51685 2/20 0.56
POLB P06746 1/20 0.56
METAP1 P53582 1/20 0.56
BLM P54132 1/20 0.56
HIF1A Q16665 1/20 0.56
DOHH Q9BU89 1/20 0.56
P4HTM Q9NXG6 1/20 0.56
CYP2A6 P11509 1/20 0.50
CYP2D6 P10635 1/20 0.50
CYP19A1 P11511 1/20 0.50
CYP2C9 P11712 1/20 0.50
CYP2C19 P33261 1/20 0.50
NPC1 O15118 5/20 0.48
RAB9A P51151 5/20 0.48
TP53 P04637 3/20 0.48

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
SCHEMBL30989132 0.88 KDM4E (0.72) KDM4ELMNACYP1A2CCR1CCR5
SCHEMBL30989133 0.88 KDM4E (0.72) KDM4ELMNACYP1A2CCR1CCR5
SCHEMBL1566968 0.88 KDM4E (0.72) KDM4ELMNACYP1A2CCR1CCR5
SCHEMBL21988557 0.88 KDM4E (0.48) KDM4ELMNACYP1A2CCR1CCR5
SCHEMBL31400236 0.88 KDM4E (0.48) KDM4ELMNACYP1A2CCR1CCR5
SCHEMBL26552270 0.87 KDM4E (0.48) KDM4ELMNACYP1A2CCR1CCR5
SCHEMBL26563997 0.87 KDM4E (0.48) KDM4ELMNACYP1A2CCR1CCR5
SCHEMBL26553096 0.86 KDM4E (0.47) KDM4ELMNACYP1A2CCR1CCR5
SCHEMBL26556289 0.86 KDM4E (0.47) KDM4ELMNACYP1A2CCR1CCR5
SCHEMBL29984274 0.85 KDM4E (0.68) KDM4ELMNACYP1A2CCR1CCR5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-104356053-B Preparation method of 2-(3-halogen phenyl) pyridine derivative 天津大学 2017-01-18 CN claimed
CN-104356053-A Preparation method of 2-(3-halogen phenyl) pyridine derivative UNIV TIANJIN 2015-02-18 CN claimed
WO-2023138254-A1 HETEROCYCLIC COMPOUND, AND ORGANIC ELECTROLUMINESCENT MATERIAL AND ELEMENT 上海八亿时空先进材料有限公司 2023-07-27 WO disclosed
US-11358951-B2 Π(PI)-conjugated compound, organic electroluminescence element material, light-emitting material, light-emitting thin film, organic electroluminescence element, display device, and illumination device MERCK PATENT GMBH (DE) 2022-06-14 US disclosed
EP-3601304-A1 METAL COMPLEXES Merck Patent GmbH (DE) 2020-02-05 EP disclosed
WO-2020016233-A1 COMPOUND AND ORGANIC SEMICONDUCTING LAYER, ORGANIC ELECTRONIC DEVICE, DISPLAY DEVICE AND LIGHTING DEVICE COMPRISING THE SAME NOVALED GMBH (DE) 2020-01-23 WO disclosed
CN-110461859-A Metal complex MERCK PATENT GMBH 2019-11-15 CN disclosed
EP-3483157-A1 COMPOUNDS COMPRISING TRIAZINE GROUP, FLUORENE-GROUP AND HETERO-FLUORENE GROUP Novaled GmbH (DE) 2019-05-15 EP disclosed
WO-2018178001-A1 METAL COMPLEXES MERCK PATENT GMBH (DE) 2018-10-04 WO disclosed
US-20180170914-A1 II(PI)-CONJUGATED COMPOUND, ORGANIC ELECTROLUMINESCENCE ELEMENT MATERIAL, LIGHT-EMITTING MATERIAL, LIGHT-EMITTING THIN FILM, ORGANIC ELECTROLUMINESCENCE ELEMENT, DISPLAY DEVICE, AND ILLUMINATION DEVICE Konica Minolta, Inc. (JP) 2018-06-21 US disclosed
US-20180019407-A1 PHENANTHROLINE DERIVATIVE, ELECTRONIC DEVICE CONTAINING SAME, LIGHT EMITTING ELEMENT, AND PHOTOELECTRIC CONVERSION ELEMENT TORAY INDUSTRIES, INC (JP) 2018-01-18 US disclosed
US-9078330-B2 Highly branched dendrimers ISIS INNOVATION LIMITED (GB) 2015-07-07 US disclosed
US-9078330-B2 Highly branched dendrimers ISIS INNOVATION LIMITED (GB) 2015-07-07 US disclosed
CN-104356053-A Preparation method of 2-(3-halogen phenyl) pyridine derivative UNIV TIANJIN 2015-02-18 CN disclosed
EP-2612669-A2 USE OF THE FETAL REPROGRAMMING OF A PPAR AGONIST SNU R & DB Foundation (KR) 2013-07-10 EP disclosed
WO-2011055912-A1 NOVEL ORGANIC ELECTROLUMINESCENT COMPOUNDS AND ORGANIC ELECTROLUMINESCENT DEVICE USING THE SAME ROHM AND HAAS ELECTRONIC MATERIALS KOREA LTD. (KR) 2011-05-12 WO disclosed
WO-2009036175-A2 F1F0-ATPASE INHIBITORS AND RELATED METHODS THE REGENTS OF THE UNIVERSITY OF MICHIGAN (US) 2009-03-19 WO disclosed
US-20080211391-A1 Highly Branched Dendrimers CAMBRIDGE DISPLAY TECHNOLOGY LIMITED (GB) 2008-09-04 US disclosed
US-20080211391-A1 Highly Branched Dendrimers CAMBRIDGE DISPLAY TECHNOLOGY LIMITED (GB) 2008-09-04 US disclosed
WO-2006097717-A1 HIGHLY BRANCHED DENDRIMERS ISIS INNOVATION LIMITED (GB) 2006-09-21 WO 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-20180019407-A1 PHENANTHROLINE DERIVATIVE, ELECTRONIC DEVICE CONTAINING SAME, LIGHT EMITTING ELEMENT, AND PHOTOELECTRIC CONVERSION ELEMENT SUN2, PAH, FARS2 KDM4E 488/4885LMNA 668/4885CYP1A2 297/4885
US-20180170914-A1 II(PI)-CONJUGATED COMPOUND, ORGANIC ELECTROLUMINESCENCE ELEMENT MATERIAL, LIGHT-EMITTING MATERIAL, LIGHT-EMITTING THIN FILM, ORGANIC ELECTROLUMINESCENCE ELEMENT, DISPLAY DEVICE, AND ILLUMINATION DEVICE OCIAD2, ZYX, OCIAD1 KDM4E 2506/4885LMNA 3244/4885CYP1A2 851/4885
US-20080211391-A1 Highly Branched Dendrimers ITGB1, PICALM, BTN3A1 KDM4E 4144/4885LMNA 977/4885CYP1A2 1616/4885
US-11358951-B2 Π(PI)-conjugated compound, organic electroluminescence element material, light-emitting material, light-emitting thin film, organic electroluminescence element, display device, and illumination device ZYX, OCIAD2, DRD1 KDM4E 2680/4885LMNA 3300/4885CYP1A2 1028/4885

“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.