SCHEMBL25112958

SCHEMBL25112958

c1ccc(-n2c(-c3c4ccccc4c(-c4ccc(-c5ccc6c(c5)c5ccccc5c5cccc7ccc8cccc6c8c75)cc4)c4ccccc34)nc3ccccc32)cc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ESR1 P03372 1/20 0.40
▸ ESR2 Q92731 1/20 0.40
▸ HTT P42858 2/20 0.39
▸ MAPK1 P28482 1/20 0.39
▸ RECQL P46063 1/20 0.38
▸ PTGER4 P35408 1/20 0.38
▸ HDAC1 Q13547 1/20 0.37
▸ HDAC8 Q9BY41 1/20 0.37
▸ HDAC6 Q9UBN7 1/20 0.37
▸ PRKACA P17612 1/20 0.37
▸ RPS6KB1 P23443 1/20 0.37
▸ GSK3B P49841 1/20 0.37
▸ ROCK1 Q13464 1/20 0.37
▸ GRIA1 P42261 1/20 0.37
▸ CACNG8 Q8WXS5 1/20 0.37
▸ CACNG2 Q9Y698 1/20 0.37
▸ KMT2A Q03164 3/20 0.36
▸ MEN1 O00255 2/20 0.36
▸ HSP90AA1 P07900 1/20 0.36
▸ MAPT P10636 1/20 0.36

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
SCHEMBL26345154 0.87 ESR1 (0.49) ESR1ESR2HTTMAPK1RECQL
SCHEMBL25112959 0.86 ESR1 (0.39) ESR1ESR2GRIA1CACNG8CACNG2
SCHEMBL25668084 0.85 ESR1 (0.47) ESR1ESR2HTTMAPK1RECQL
SCHEMBL26345151 0.85 ESR1 (0.47) ESR1ESR2HTTMAPK1RECQL
SCHEMBL12144449 0.84 ESR1 (0.43) ESR1ESR2HTTMAPK1RECQL
SCHEMBL25112972 0.83 ESR1 (0.46) ESR1ESR2HTTMAPK1RECQL
SCHEMBL26344960 0.83 ESR1 (0.55) ESR1ESR2HTTMAPK1RECQL
SCHEMBL25688165 0.83 ESR1 (0.48) ESR1ESR2HTTMAPK1RECQL
SCHEMBL26825359 0.83 ESR1 (0.50) ESR1ESR2HTTMAPK1RECQL
SCHEMBL18999498 0.83 ESR1 (0.56) ESR1ESR2HTTMAPK1RECQL

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230085328-A1 COMPOUND, MATERIAL FOR ORGANIC ELECTROLUMINESCENT ELEMENTS, ORGANIC ELECTROLUMINESCENT ELEMENT, AND ELECTRONIC DEVICE IDEMITSU KOSAN CO.,LTD. (JP) 2023-03-16 — — 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-20230085328-A1 COMPOUND, MATERIAL FOR ORGANIC ELECTROLUMINESCENT ELEMENTS, ORGANIC ELECTROLUMINESCENT ELEMENT, AND ELECTRONIC DEVICE L1CAM, PIEZO1, LEF1 ESR1 42/4885ESR2 302/4885HTT 3295/4885

“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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