SCHEMBL17658581

SCHEMBL17658581

CSc1cc(Br)ccc1I

nearest known ligand 0.35

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.35
CCR2 P41597 1/20 0.35
CYP2A6 P11509 2/20 0.30
ALOX15 P16050 1/20 0.30
MAPK1 P28482 1/20 0.30
AHR P35869 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
SCHEMBL30031713 1.00 ALDH1A1 (0.35) ALDH1A1CCR2CYP2A6ALOX15MAPK1
SCHEMBL30160073 0.82 ALDH1A1 (0.39) ALDH1A1CCR2CYP2A6ALOX15MAPK1
SCHEMBL17646099 0.82 ALDH1A1 (0.39) ALDH1A1CCR2CYP2A6ALOX15MAPK1
SCHEMBL3107273 0.78 ALDH1A1 (0.38) ALDH1A1CCR2CYP2A6ALOX15MAPK1
SCHEMBL2874105 0.77 ALDH1A1 (0.40) ALDH1A1CCR2MAPK1
SCHEMBL19643087 0.77 AOC3 (0.32)
SCHEMBL18433347 0.76 KMT2A (0.43) ALDH1A1CYP2A6ALOX15
SCHEMBL2591899 0.74 ALDH1A1 (0.36) ALDH1A1CCR2CYP2A6ALOX15MAPK1
SCHEMBL5946318 0.73 KDM4E (0.41) ALDH1A1ALOX15MAPK1
SCHEMBL18297432 0.73 HSD17B10 (0.36) ALDH1A1ALOX15

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4307402-B1 ORGANIC LIGHT EMITTING DEVICE LG CHEMICAL LTD (KR) 2025-06-25 EP disclosed
US-20240206332-A1 ORGANIC LIGHT EMITTING DEVICE LG CHEM, LTD. (KR) 2024-06-20 US disclosed
CN-113166131-B Novel compound and organic light emitting device comprising the same 株式会社LG化学 2024-05-17 CN disclosed
EP-4307402-A1 ORGANIC LIGHT EMITTING DEVICE Lg Chem, Ltd. (KR) 2024-01-17 EP disclosed
EP-4307402-A1 ORGANIC LIGHT EMITTING DEVICE Lg Chem, Ltd. (KR) 2024-01-17 EP disclosed
CN-117044425-A Organic light emitting device 株式会社LG化学 2023-11-10 CN disclosed
WO-2022225349-A1 ORGANIC LIGHT EMITTING DEVICE 주식회사 엘지화학 2022-10-27 WO disclosed
CN-113166131-A Novel compound and organic light emitting device comprising same 株式会社LG化学 2021-07-23 CN disclosed
WO-2020235976-A1 NOVEL COMPOUND AND ORGANIC LIGHT EMITTING DEVICE USING SAME 주식회사 엘지화학 (KR) 2020-11-26 WO disclosed
WO-2020235976-A1 NOVEL COMPOUND AND ORGANIC LIGHT EMITTING DEVICE USING SAME 주식회사 엘지화학 (KR) 2020-11-26 WO disclosed
WO-2019027163-A1 COMPOUND FOR ORGANIC ELECTRIC ELEMENT, ORGANIC ELECTRIC ELEMENT USING SAME, AND ELECTRONIC DEVICE USING SAME 덕산네오룩스 주식회사 2019-02-07 WO disclosed
US-9923147-B2 Organic light emitting device SAMSUNG DISPLAY CO., LTD. (KR) 2018-03-20 US disclosed
US-9856243-B2 Condensed cyclic compound and organic light-emitting device including the same SAMSUNG DISPLAY CO., LTD. (KR) 2018-01-02 US disclosed
US-20160329501-A1 ORGANIC LIGHT EMITTING DEVICE SAMSUNG DISPLAY CO., LTD. (KR) 2016-11-10 US disclosed
US-20160329501-A1 ORGANIC LIGHT EMITTING DEVICE SAMSUNG DISPLAY CO., LTD. (KR) 2016-11-10 US disclosed
EP-3006436-A1 CONDENSED CYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME Samsung Display Co., Ltd. (KR) 2016-04-13 EP disclosed
US-20160099423-A1 CONDENSED CYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME SAMSUNG DISPLAY CO., LTD. (KR) 2016-04-07 US disclosed
US-20160099423-A1 CONDENSED CYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME SAMSUNG DISPLAY CO., LTD. (KR) 2016-04-07 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 (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-20160099423-A1 CONDENSED CYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME CRY1, CRY2, MCM4 ALDH1A1 471/4885CCR2 1430/4885CYP2A6 1265/4885

“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.