SCHEMBL1068328

SCHEMBL1068328

c1cc2cccc3c4nnnc5nccc(c(c1)c23)c54

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 2/20 0.35
▸ HPGD P15428 2/20 0.35
▸ HSD17B10 Q99714 2/20 0.35
▸ CYP1A2 P05177 2/20 0.35
▸ THRB P10828 1/20 0.35
▸ PLAU P00749 2/20 0.33
▸ PLG P00747 1/20 0.33
▸ MAPT P10636 2/20 0.32
▸ KDM4E B2RXH2 1/20 0.32
▸ GAA P10253 1/20 0.32
▸ MAOA P21397 2/20 0.32
▸ LMNA P02545 1/20 0.31
▸ CYP3A4 P08684 1/20 0.31
▸ APEX1 P27695 1/20 0.31
▸ MAPK1 P28482 1/20 0.31
▸ PMP22 Q01453 1/20 0.31
▸ CYP2A6 P11509 1/20 0.31
▸ F12 P00748 1/20 0.31
▸ NCF1 P14598 1/20 0.31
▸ NOS3 P29474 1/20 0.31

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
SCHEMBL29475320 0.72 CYP1A2 (0.44) ALDH1A1HPGDHSD17B10CYP1A2THRB
SCHEMBL30022648 0.72 CYP1A2 (0.44) ALDH1A1HPGDHSD17B10CYP1A2THRB
SCHEMBL5471458 0.72 CYP1A2 (0.44) ALDH1A1HPGDHSD17B10CYP1A2THRB
SCHEMBL30421514 0.71 CYP1A2 (0.43) ALDH1A1HPGDHSD17B10CYP1A2THRB
SCHEMBL9999520 0.69 CYP1A2 (0.41) ALDH1A1HPGDHSD17B10CYP1A2THRB
SCHEMBL5473607 0.69 CYP1A2 (0.44) ALDH1A1HPGDHSD17B10CYP1A2THRB
SCHEMBL21885748 0.68 ALDH1A1 (0.67) ALDH1A1HPGDHSD17B10CYP1A2THRB
SCHEMBL21885746 0.68 ALDH1A1 (0.67) ALDH1A1HPGDHSD17B10CYP1A2THRB
SCHEMBL21885745 0.68 ALDH1A1 (0.67) ALDH1A1HPGDHSD17B10CYP1A2THRB
SCHEMBL9999521 0.68 CYP1A2 (0.46) ALDH1A1HPGDHSD17B10CYP1A2THRB

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
WO-2023152063-A1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES MERCK PATENT GMBH (DE) 2023-08-17 — — WO disclosed
WO-2023110742-A1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES MERCK PATENT GMBH (DE) 2023-06-22 — — WO disclosed
CN-114057752-B Tetraazafluoranthene compound and application thereof 上海八亿时空先进材料有限公司 2023-04-07 — — CN disclosed
US-8993123-B2 Materials for organic electroluminescent devices MERCK PATENT GMBH (DE) 2015-03-31 — — US disclosed
WO-2011009522-A2 MATERIALS FOR ELECTRONIC DEVICES MERCK PATENT GMBH (DE) 2011-01-27 — — WO disclosed
US-20100327270-A1 NOVEL MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES MERCK PATENT GMBH (DE) 2010-12-30 — — US disclosed
US-5095103-A POLYCYCLIC AROMATIC AZACYCLIC COMPOUNDS USEFUL IN DYEING BAYER AKTIENGESELLSCHAFT (DE) 1992-03-10 — — 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-20100327270-A1 NOVEL MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES L1CAM, ELAVL1, EPCAM ALDH1A1 336/4885HPGD 2665/4885HSD17B10 2767/4885

“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.

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