SCHEMBL5428518

SCHEMBL5428518

CCn1cnc2c(=O)[nH]c(=S)[nH]c21

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ GAA P10253 1/20 0.40
▸ KMT2A Q03164 2/20 0.40
▸ MEN1 O00255 1/20 0.39
▸ ADORA2A P29274 3/20 0.38
▸ PDE4A P27815 2/20 0.38
▸ PDE4B Q07343 2/20 0.38
▸ PDE4C Q08493 2/20 0.38
▸ PDE4D Q08499 2/20 0.38
▸ PNP P00491 2/20 0.37
▸ BRD4 O60885 4/20 0.37
▸ BRD2 P25440 2/20 0.37
▸ BRD3 Q15059 2/20 0.37
▸ BRDT Q58F21 2/20 0.37
▸ NSD2 O96028 1/20 0.36
▸ CASP6 P55212 1/20 0.36
▸ ADORA1 P30542 1/20 0.35
▸ PI4KA P42356 1/20 0.35
▸ PI4K2B Q8TCG2 1/20 0.35
▸ PI4K2A Q9BTU6 1/20 0.35
▸ PI4KB Q9UBF8 1/20 0.35

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
SCHEMBL5431750 0.88 GAA (0.48) GAAKMT2AMEN1ADORA2APDE4A
SCHEMBL13728723 0.85 GAA (0.59) GAAKMT2AMEN1ADORA2APDE4A
SCHEMBL380137 0.83 PNP (0.50) GAAKMT2AADORA2APDE4APDE4B
SCHEMBL7217325 0.82 PNP (0.49) GAAKMT2AADORA2APDE4APDE4B
SCHEMBL7329915 0.82 KDM4E (0.42) GAAKMT2AMEN1ADORA2APDE4A
SCHEMBL3141045 0.81 KMT2A (0.43) GAAKMT2AMEN1PNPKDM4E
SCHEMBL4090390 0.80 CYP1A2 (0.46) GAAKMT2AMEN1PNPSMN1; SMN2
SCHEMBL5429638 0.79 CYP11B2 (0.37) GAAKMT2AMEN1PNPTK1
SCHEMBL4379221 0.78 KMT2A (0.45) GAAKMT2AMEN1ADORA2APDE4A
SCHEMBL27277482 0.77 ALDH1A1 (0.52) GAAKMT2AADORA2APDE4APDE4B

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-20070135454-A1 Bicyclic pyrimidin-4(3h)-ones and analogues and derivatives thereof which modulate the function of the vanilloid-1-receptor(vr1) BAYLISS TRACY 2007-06-14 — — 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-20070135454-A1 Bicyclic pyrimidin-4(3h)-ones and analogues and derivatives thereof which modulate the function of the vanilloid-1-receptor(vr1) TRPV1, TRPV2, TRPV4 GAA 4363/4885KMT2A 4422/4885MEN1 4674/4885

“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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