SCHEMBL17014606

SCHEMBL17014606

Brc1ccc(-c2cc(-c3ccccc3)c(-c3ccc(Br)cc3)c3c2-c2cccc4cccc-3c24)cc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.42
MAPK1 P28482 4/20 0.42
TSHR P16473 3/20 0.39
HSD17B10 Q99714 3/20 0.39
HPGD P15428 2/20 0.39
TP53 P04637 2/20 0.39
CASP1 P29466 1/20 0.39
CASP7 P55210 1/20 0.39
HIF1A Q16665 1/20 0.39
ATM Q13315 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
ACHE P22303 1/20 0.38
AGTR1 P30556 1/20 0.36
ADORA3 P0DMS8 1/20 0.35
ADORA2A P29274 1/20 0.35
ADORA1 P30542 1/20 0.35
NR1H4 Q96RI1 1/20 0.35
MAOB P27338 1/20 0.35
MAPT P10636 4/20 0.34
LMNA P02545 3/20 0.34

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
SCHEMBL13002341 1.00 ALDH1A1 (0.42) ALDH1A1MAPK1TSHRHSD17B10HPGD
SCHEMBL30040588 1.00 ALDH1A1 (0.42) ALDH1A1MAPK1TSHRHSD17B10HPGD
SCHEMBL24067732 0.98 ALDH1A1 (0.46) ALDH1A1MAPK1TSHRHSD17B10HPGD
SCHEMBL30041142 0.98 ALDH1A1 (0.46) ALDH1A1MAPK1TSHRHSD17B10HPGD
SCHEMBL76389 0.90 ALDH1A1 (0.44) ALDH1A1MAPK1TSHRHSD17B10HPGD
SCHEMBL2158220 0.90 ALDH1A1 (0.47) ALDH1A1MAPK1TSHRHSD17B10HPGD
SCHEMBL17014609 0.89 MAOB (0.39) ALDH1A1MAPK1TSHRHSD17B10HPGD
SCHEMBL30041352 0.89 ALDH1A1 (0.38) ALDH1A1MAPK1TSHRHSD17B10HPGD
SCHEMBL24067815 0.89 ALDH1A1 (0.38) ALDH1A1MAPK1TSHRHSD17B10HPGD
SCHEMBL728300 0.89 ALDH1A1 (0.50) ALDH1A1MAPK1TSHRHSD17B10HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230128259-A1 COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE COMPRISING SAME LG CHEM, LTD. (KR) 2023-04-27 US disclosed
US-20230128259-A1 COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE COMPRISING SAME LG CHEM, LTD. (KR) 2023-04-27 US disclosed
CN-115279732-A Compound and organic light emitting device including the same 株式会社LG化学 2022-11-01 CN disclosed
WO-2021241900-A1 COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE COMPRISING SAME 주식회사 엘지화학 2021-12-02 WO disclosed
WO-2021241900-A1 COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE COMPRISING SAME 주식회사 엘지화학 2021-12-02 WO disclosed
US-20150236273-A1 FLUORANTHENE COMPOUND, AND ORGANIC ELECTRONIC DEVICE COMPRISING SAME LG CHEM, LTD. (KR) 2015-08-20 US disclosed
US-20150236273-A1 FLUORANTHENE COMPOUND, AND ORGANIC ELECTRONIC DEVICE COMPRISING SAME LG CHEM, LTD. (KR) 2015-08-20 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 (2 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-20230128259-A1 COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE COMPRISING SAME L1CAM, CRY1, CRY2 ALDH1A1 22/4885MAPK1 1336/4885TSHR 3181/4885
US-20150236273-A1 FLUORANTHENE COMPOUND, AND ORGANIC ELECTRONIC DEVICE COMPRISING SAME AFF2, ESR1, AFF4 ALDH1A1 1216/4885MAPK1 1899/4885TSHR 3671/4885

“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.