SCHEMBL13384791

SCHEMBL13384791

Cc1ccc(-n2c(=O)c(C#N)cc3ccc(Cl)cc32)cc1C#N

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 7/20 0.41
▸ USP2 O75604 1/20 0.41
▸ HSD17B10 Q99714 1/20 0.41
▸ L3MBTL1 Q9Y468 1/20 0.41
▸ NPSR1 Q6W5P4 1/20 0.41
▸ TDP2 O95551 7/20 0.40
▸ ALDH1A1 P00352 4/20 0.40
▸ GAA P10253 4/20 0.40
▸ HPGD P15428 2/20 0.40
▸ GLA P06280 1/20 0.39
▸ MEN1 O00255 1/20 0.38
▸ LMNA P02545 1/20 0.38
▸ MAPT P10636 1/20 0.38
▸ HTT P42858 1/20 0.38
▸ KMT2A Q03164 1/20 0.38
▸ SMN1; SMN2 Q16637 1/20 0.38
▸ GPR35 Q9HC97 1/20 0.37
▸ MAT2A P31153 2/20 0.37
▸ ESR1 P03372 1/20 0.37
▸ ESR2 Q92731 1/20 0.37

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
SCHEMBL13384773 0.85 TDP2 (0.43) KDM4EUSP2HSD17B10L3MBTL1TDP2
SCHEMBL13384775 0.85 KDM4E (0.40) KDM4EUSP2HSD17B10L3MBTL1TDP2
SCHEMBL31339890 0.84 ALDH1A1 (0.50) KDM4ENPSR1TDP2ALDH1A1GAA
SCHEMBL13384798 0.83 KDM4E (0.47) KDM4EUSP2HSD17B10L3MBTL1ALDH1A1
SCHEMBL13384765 0.83 KDM4E (0.45) KDM4EHSD17B10L3MBTL1NPSR1TDP2
SCHEMBL31339816 0.82 TDP2 (0.51) KDM4EL3MBTL1TDP2ALDH1A1GAA
SCHEMBL13384794 0.80 KDM4E (0.47) KDM4EUSP2HSD17B10L3MBTL1NPSR1
SCHEMBL13384781 0.78 CHEK1 (0.38) KDM4EUSP2HSD17B10L3MBTL1TDP2
SCHEMBL13384796 0.78 KDM4E (0.46) KDM4EUSP2HSD17B10L3MBTL1NPSR1
SCHEMBL13384795 0.78 KDM4E (0.46) KDM4EUSP2HSD17B10L3MBTL1NPSR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100087649-A1 QUINOLINONE DERIVATIVES TIBOTEC BVBA (BE) 2010-04-08 — — US disclosed
US-20100087649-A1 QUINOLINONE DERIVATIVES TIBOTEC BVBA (BE) 2010-04-08 — — US disclosed
WO-2008037784-A1 QUINOLINONE DERIVATIVES TIBOTEC PHARMACEUTICALS LTD. (IE) 2008-04-03 — — WO 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-20100087649-A1 QUINOLINONE DERIVATIVES CHRM1, CYP2C8, CCR8 KDM4E 2122/4885USP2 3250/4885HSD17B10 1071/4885

“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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