SCHEMBL17548772

SCHEMBL17548772

Brc1cccc2c1sc1ccc(I)cc12

nearest known ligand 0.35

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 1/20 0.35
CDK9 P50750 1/20 0.34
DYRK1A Q13627 1/20 0.34
DYRK2 Q92630 1/20 0.34
DYRK1B Q9Y463 1/20 0.34
ALOX5 P09917 1/20 0.33
PSMB8 P28062 1/20 0.32
IDO1 P14902 1/20 0.32
TDO2 P48775 1/20 0.32
SLC9A1 P19634 1/20 0.31
GPR3 P46089 1/20 0.30
EGFR P00533 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
SCHEMBL17548826 0.83 PTPN1 (0.37) PTPN1ALOX5GPR3
SCHEMBL25465865 0.82 ALOX5 (0.41) PTPN1ALOX5PSMB8IDO1TDO2
SCHEMBL22389511 0.82 PTPN1 (0.39) PTPN1ALOX5PSMB8IDO1TDO2
SCHEMBL15989726 0.79 KDM4E (0.47) IDO1TDO2
SCHEMBL3714695 0.79 ALDH1A1 (0.44) PTPN1ALOX5IDO1TDO2SLC9A1
SCHEMBL29450781 0.79 KDM4E (0.47) IDO1TDO2
SCHEMBL3717891 0.79 ALOX5 (0.39) PTPN1ALOX5PSMB8IDO1TDO2
SCHEMBL232632 0.77 GPR3 (0.54) PTPN1ALOX5PSMB8TDO2SLC9A1
SCHEMBL25270552 0.77 LIMK1 (0.47) PTPN1ALOX5
SCHEMBL17252505 0.76 GPR3 (0.34) PTPN1CDK9DYRK1ADYRK2DYRK1B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3831819-B1 HETEROCYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME SAMSUNG ELECTRONICS CO LTD (KR) 2026-01-14 EP disclosed
CN-112979597-B Heterocyclic compound and organic light-emitting device including the same 三星电子株式会社 2025-05-13 CN disclosed
CN-117551045-A Compound, organic electroluminescent device and display device 阜阳欣奕华材料科技有限公司 2024-02-13 CN disclosed
US-11683982-B2 Organic compound having excellent thermal resistance property and luminescent property, organic light emitting diode and organic light emitting device having the compound LG DISPLAY CO., LTD. (KR) 2023-06-20 US disclosed
US-11683982-B2 Organic compound having excellent thermal resistance property and luminescent property, organic light emitting diode and organic light emitting device having the compound LG DISPLAY CO., LTD. (KR) 2023-06-20 US disclosed
US-11659766-B2 Organic semiconductor material for electron transport DAEGU GYEONGBUK INSTITUTE OF SCIENCE & TECHNOLOGY (KR) 2023-05-23 US disclosed
US-11659766-B2 Organic semiconductor material for electron transport DAEGU GYEONGBUK INSTITUTE OF SCIENCE & TECHNOLOGY (KR) 2023-05-23 US disclosed
CN-112979597-A Heterocyclic compound and organic light-emitting device including the same 三星电子株式会社 2021-06-18 CN disclosed
EP-3831819-A1 HETEROCYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME Samsung Electronics Co., Ltd. (KR) 2021-06-09 EP disclosed
US-20210167299-A1 HETEROCYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME SAMSUNG ELECTRONICS CO., LTD. (KR) 2021-06-03 US disclosed
US-20170256719-A1 COMPOUND FOR ORGANIC ELECTRONIC ELEMENT, ORGANIC ELECTRICAL ELEMENT USING COMPOUND, AND ELECTRONIC DEVICE COMPRISING SAME DUK SAN NEOLUX CO., LTD (KR) 2017-09-07 US disclosed
US-20170256719-A1 COMPOUND FOR ORGANIC ELECTRONIC ELEMENT, ORGANIC ELECTRICAL ELEMENT USING COMPOUND, AND ELECTRONIC DEVICE COMPRISING SAME DUK SAN NEOLUX CO., LTD (KR) 2017-09-07 US disclosed
WO-2016032150-A2 COMPOUND FOR ORGANIC ELECTRICAL ELEMENT, ORGANIC ELECTRICAL ELEMENT USING COMPOUND, AND ELECTRONIC DEVICE COMPRISING SAME 덕산네오룩스 주식회사 2016-03-03 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 (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-11683982-B2 Organic compound having excellent thermal resistance property and luminescent property, organic light emitting diode and organic light emitting device having the compound DDT, DBF4, L3MBTL4 PTPN1 4083/4885CDK9 1022/4885DYRK1A 956/4885
US-20170256719-A1 COMPOUND FOR ORGANIC ELECTRONIC ELEMENT, ORGANIC ELECTRICAL ELEMENT USING COMPOUND, AND ELECTRONIC DEVICE COMPRISING SAME ORAI2, VDAC2, PIEZO1 PTPN1 3949/4885CDK9 731/4885DYRK1A 4019/4885
US-20210167299-A1 HETEROCYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME CYP1A1, AOX1, OXER1 PTPN1 4513/4885CDK9 1488/4885DYRK1A 4659/4885

“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.