SCHEMBL25112950

SCHEMBL25112950

c1ccc(-n2c(-c3cc4cccc5c6ccccc6c6ccccc6c6cccc3c6c45)nc3ccccc32)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RECQL P46063 1/20 0.50
MAPK1 P28482 1/20 0.47
HTT P42858 1/20 0.47
ESR2 Q92731 5/20 0.44
ESR1 P03372 4/20 0.44
RPS6KB1 P23443 2/20 0.43
PRKACA P17612 1/20 0.43
GSK3B P49841 1/20 0.43
ROCK1 Q13464 1/20 0.43
RAB9A P51151 1/20 0.41
HDAC1 Q13547 1/20 0.40
HDAC8 Q9BY41 1/20 0.40
HDAC6 Q9UBN7 1/20 0.40
GSR P00390 1/20 0.40
KDM4E B2RXH2 4/20 0.39
ALDH1A1 P00352 3/20 0.39
HPGD P15428 3/20 0.39
GRIA1 P42261 1/20 0.38
CACNG8 Q8WXS5 1/20 0.38
CACNG2 Q9Y698 1/20 0.38

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
SCHEMBL25112895 0.90 ESR1 (0.49) RECQLMAPK1HTTESR2ESR1
SCHEMBL25112939 0.89 ESR1 (0.48) RECQLMAPK1HTTESR2ESR1
SCHEMBL9976896 0.88 RECQL (0.51) RECQLMAPK1HTTESR2ESR1
SCHEMBL12144421 0.88 RECQL (0.56) RECQLMAPK1HTTESR2ESR1
SCHEMBL25112903 0.87 ESR1 (0.54) RECQLMAPK1HTTESR2ESR1
SCHEMBL9976925 0.86 RECQL (0.55) RECQLMAPK1HTTESR2ESR1
SCHEMBL25112785 0.86 ESR1 (0.47) RECQLMAPK1HTTESR2ESR1
SCHEMBL18174846 0.83 ESR1 (0.49) RECQLMAPK1HTTESR2ESR1
SCHEMBL25112787 0.82 ESR1 (0.52) RECQLMAPK1HTTESR2ESR1
SCHEMBL9611744 0.82 RECQL (0.48) RECQLMAPK1HTTESR2ESR1

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 RECQL 2598/4885MAPK1 154/4885HTT 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.