SCHEMBL13025165

SCHEMBL13025165

[C-]#[N+]c1c(Cl)c2ccccc2n(Cc2ccc(OC)cc2)c1=O

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ P2RX4 Q99571 1/20 0.61
▸ GABRA5 P31644 1/20 0.49
▸ TDP1 Q9NUW8 1/20 0.49
▸ L3MBTL1 Q9Y468 1/20 0.49
▸ SMN1; SMN2 Q16637 2/20 0.48
▸ POLB P06746 1/20 0.48
▸ GAA P10253 1/20 0.48
▸ MAPK1 P28482 1/20 0.48
▸ MEN1 O00255 2/20 0.47
▸ KMT2A Q03164 2/20 0.47
▸ HDAC1 Q13547 2/20 0.46
▸ HDAC11 Q96DB2 1/20 0.46
▸ HDAC8 Q9BY41 1/20 0.46
▸ HDAC6 Q9UBN7 1/20 0.46
▸ MAPT P10636 1/20 0.46
▸ CASP3 P42574 1/20 0.45
▸ HSPD1 P10809 1/20 0.44
▸ HSPE1 P61604 1/20 0.44
▸ ALDH1A1 P00352 1/20 0.44
▸ PTPN1 P18031 1/20 0.44

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
SCHEMBL13025166 0.86 HSPD1 (0.58) P2RX4L3MBTL1SMN1; SMN2POLBMAPK1
SCHEMBL13025171 0.84 KDM4E (0.51) P2RX4GABRA5TDP1L3MBTL1MAPT
SCHEMBL10314603 0.83 P2RX4 (0.67) P2RX4GABRA5TDP1L3MBTL1SMN1; SMN2
SCHEMBL13025168 0.82 PDE1A (0.41) P2RX4L3MBTL1POLBMEN1KMT2A
SCHEMBL13025167 0.81 SRC (0.44) SMN1; SMN2MEN1KMT2AMAPT
SCHEMBL2863880 0.80 P2RX4 (0.62) P2RX4GABRA5TDP1L3MBTL1SMN1; SMN2
SCHEMBL27836563 0.79 P2RX4 (0.61) P2RX4GABRA5TDP1L3MBTL1SMN1; SMN2
SCHEMBL13025172 0.79 KDM4E (0.46) P2RX4SMN1; SMN2GAAMAPK1MEN1
SCHEMBL13025207 0.78 P2RX4 (0.43) P2RX4GABRA5SMN1; SMN2POLBGAA
SCHEMBL14160793 0.76 P2RX4 (1.00) P2RX4GABRA5TDP1L3MBTL1SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7842701-B2 Pyrazoloquinolone derivative and use thereof TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2010-11-30 — — US disclosed
US-20070281963-A1 Pyrazoloquinolone Derivative And Use Thereof TAKEDA PHARMACEUTICAL COMPANY (JP) 2007-12-06 — — 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-20070281963-A1 Pyrazoloquinolone Derivative And Use Thereof MAP3K20, MAP4K5, MAP4K3 P2RX4 718/4885GABRA5 2689/4885TDP1 2985/4885

“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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