SCHEMBL6460823

SCHEMBL6460823

NC(=O)c1ccccc1C(=O)c1cccc2ccccc12

nearest known ligand 0.70

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CDC25B P30305 3/20 0.70
▸ NR4A1 P22736 1/20 0.57
▸ NR4A2 P43354 1/20 0.57
▸ NR4A3 Q92570 1/20 0.57
▸ CNR2 P34972 6/20 0.56
▸ KDM4E B2RXH2 3/20 0.55
▸ GAA P10253 2/20 0.55
▸ ALDH1A1 P00352 1/20 0.55
▸ POLB P06746 1/20 0.54
▸ SMN1; SMN2 Q16637 1/20 0.54
▸ KMT2A Q03164 3/20 0.53
▸ MEN1 O00255 2/20 0.53
▸ MAPT P10636 1/20 0.53
▸ HTT P42858 1/20 0.53
▸ NPSR1 Q6W5P4 1/20 0.53
▸ TDP1 Q9NUW8 1/20 0.53
▸ L3MBTL1 Q9Y468 1/20 0.53
▸ MMP3 P08254 1/20 0.52
▸ HDAC8 Q9BY41 1/20 0.52
▸ CNR1 P21554 4/20 0.50

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
SCHEMBL29381201 0.88 KDM4E (0.68) CDC25BNR4A1NR4A2NR4A3CNR2
SCHEMBL43084 0.88 KDM4E (0.68) CDC25BNR4A1NR4A2NR4A3CNR2
SCHEMBL29414437 0.88 CDC25B (0.80) CDC25BNR4A1NR4A2NR4A3CNR2
SCHEMBL244802 0.88 CDC25B (0.80) CDC25BNR4A1NR4A2NR4A3CNR2
Hydrochloric Acid SCHEMBL3149083 0.86 KDM4E (0.66) CDC25BNR4A1NR4A2NR4A3CNR2
SCHEMBL18859029 0.86 KDM4E (0.66) CDC25BNR4A1NR4A2NR4A3CNR2
SCHEMBL9011545 0.86 KDM4E (0.66) CDC25BNR4A1NR4A2NR4A3CNR2
SCHEMBL18859030 0.86 KDM4E (0.66) CDC25BNR4A1NR4A2NR4A3KDM4E
SCHEMBL14837757 0.86 KDM4E (0.66) CDC25BNR4A1NR4A2NR4A3CNR2
Ammonia Solution, Strong SCHEMBL1553414 0.86 KDM4E (0.66) CDC25BNR4A1NR4A2NR4A3CNR2

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-20050197350-A1 Novel quinoline, tetrahydroquinazoline, and pyrimidine derivatives and methods of treatment related to the use thereof TAISHO PHARMACEUTICAL CO., LTD. 2005-09-08 — — 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-20050197350-A1 Novel quinoline, tetrahydroquinazoline, and pyrimidine derivatives and methods of treatment related to the use thereof HCRTR2, MCHR1, MCHR2 CDC25B 770/4885NR4A1 1035/4885NR4A2 1029/4885

“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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