SCHEMBL18192017

SCHEMBL18192017

O=C(Cl)c1cnc(Br)cn1

nearest known ligand 0.42

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
SIRT6 Q8N6T7 2/20 0.42
KDM4E B2RXH2 1/20 0.38
ALDH1A1 P00352 1/20 0.38
BACE1 P56817 1/20 0.31
P4HA1 P13674 1/20 0.30
MIF P14174 1/20 0.30
P4HTM Q9NXG6 1/20 0.30
JUN P05412 1/20 0.30
NFKB1 P19838 1/20 0.30
NFKB2 Q00653 1/20 0.30
RELA Q04206 1/20 0.30

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
SCHEMBL11421909 0.85 SIRT6 (0.52) SIRT6KDM4EALDH1A1P4HA1MIF
SCHEMBL31697733 0.79 KDM4E (0.54) SIRT6KDM4EALDH1A1P4HA1MIF
SCHEMBL1656658 0.79 KDM4E (0.54) SIRT6KDM4EALDH1A1P4HA1MIF
SCHEMBL2024145 0.77 SIRT6 (0.57) SIRT6KDM4EALDH1A1P4HA1MIF
SCHEMBL29844782 0.77 SIRT6 (0.57) SIRT6KDM4EALDH1A1P4HA1MIF
SCHEMBL31146089 0.77 KCNJ1 (0.43) SIRT6KDM4EALDH1A1BACE1P4HA1
Hydrochloric Acid SCHEMBL20396063 0.77 KDM4E (0.52) SIRT6KDM4EALDH1A1P4HA1MIF
SCHEMBL30263065 0.76 SIRT6 (0.68) SIRT6ALDH1A1P4HA1MIFP4HTM
SCHEMBL107129 0.76 SIRT6 (0.68) SIRT6ALDH1A1P4HA1MIFP4HTM
SCHEMBL29202158 0.74 KCNJ1 (0.44) SIRT6KDM4EALDH1A1P4HA1MIF

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11342511-B2 Azoline ring-containing compound, electron transport/injection layer material containing the same, and organic electroluminescent element using the same SK MATERIALS JNC CO., LTD. (KR) 2022-05-24 US disclosed
CN-107531641-B Material for transporting electrons, organic electroluminescent element, and display device or lighting device 爱思开新材料捷恩智株式会社 2022-03-15 CN disclosed
CN-108191761-B Heterocyclic compound and organic light-emitting device using the same LT素材株式会社 2021-12-21 CN disclosed
EP-3088392-B1 HETEROCYCLIC COMPOUND AND ORGANIC LIGHT EMITTING DEVICE USING SAME HEESUNG MAT LTD (KR) 2020-03-11 EP disclosed
CN-105358533-B Heterocyclic compound and organic light-emitting device using the same 喜星素材株式会社 2018-08-28 CN disclosed
US-20180212156-A1 AZOLINE RING-CONTAINING COMPOUND, ELECTRON TRANSPORT/INJECTION LAYER MATERIAL CONTAINING THE SAME, AND ORGANIC ELECTROLUMINESCENT ELEMENT USING THE SAME JNC CORPORATION (JP) 2018-07-26 US disclosed
CN-108191761-A Heterocyclic compound and use its organic luminescent device 喜星素材株式会社 2018-06-22 CN disclosed
US-9728731-B2 Heterocyclic compound and organic light emitting device using same HEESUNG MATERIAL LTD. (KR) 2017-08-08 US disclosed
US-9728731-B2 Heterocyclic compound and organic light emitting device using same HEESUNG MATERIAL LTD. (KR) 2017-08-08 US disclosed
US-9728731-B2 Heterocyclic compound and organic light emitting device using same HEESUNG MATERIAL LTD. (KR) 2017-08-08 US disclosed
US-20160380208-A1 HETEROCYCLIC COMPOUND AND ORGANIC LIGHT EMITTING DEVICE USING SAME HEESUNG MATERIAL LTD. (KR) 2016-12-29 US disclosed
US-20160380208-A1 HETEROCYCLIC COMPOUND AND ORGANIC LIGHT EMITTING DEVICE USING SAME HEESUNG MATERIAL LTD. (KR) 2016-12-29 US disclosed
EP-3088392-A1 HETEROCYCLIC COMPOUND AND ORGANIC LIGHT EMITTING DEVICE USING SAME Heesung Material Ltd. (KR) 2016-11-02 EP disclosed
EP-3088392-A1 HETEROCYCLIC COMPOUND AND ORGANIC LIGHT EMITTING DEVICE USING SAME Heesung Material Ltd. (KR) 2016-11-02 EP disclosed
CN-105358533-A Heterocyclic compound and organic light-emitting device using the same HEESUNG MAT LTD 2016-02-24 CN 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 (3 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-11342511-B2 Azoline ring-containing compound, electron transport/injection layer material containing the same, and organic electroluminescent element using the same SLC7A5, EML4, ARNT SIRT6 4177/4885KDM4E 776/4885ALDH1A1 1266/4885
US-20160380208-A1 HETEROCYCLIC COMPOUND AND ORGANIC LIGHT EMITTING DEVICE USING SAME NOTUM, DDT, CRY1 SIRT6 695/4885KDM4E 1977/4885ALDH1A1 85/4885
US-20180212156-A1 AZOLINE RING-CONTAINING COMPOUND, ELECTRON TRANSPORT/INJECTION LAYER MATERIAL CONTAINING THE SAME, AND ORGANIC ELECTROLUMINESCENT ELEMENT USING THE SAME SLC7A5, EML4, ARNT SIRT6 4177/4885KDM4E 776/4885ALDH1A1 1266/4885

“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.