SCHEMBL4212917

SCHEMBL4212917

Cc1cc(Nc2ccc(Cl)cc2)nc(-n2nc(C)cc2C)n1

nearest known ligand 0.80

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ TP53 P04637 4/20 0.80
▸ LMNA P02545 3/20 0.76
▸ POLB P06746 3/20 0.76
▸ KCNN3 Q9UGI6 3/20 0.75
▸ NPSR1 Q6W5P4 2/20 0.72
▸ HIF1A Q16665 1/20 0.72
▸ MAPT P10636 2/20 0.68
▸ ALOX15 P16050 2/20 0.67
▸ TSHR P16473 1/20 0.67
▸ MAPK1 P28482 1/20 0.67
▸ SMN1; SMN2 Q16637 1/20 0.67
▸ BCL6 P41182 1/20 0.60
▸ KCNN2 Q9H2S1 1/20 0.59

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
SCHEMBL2448726 0.90 TP53 (0.65) TP53LMNAPOLBKCNN3NPSR1
SCHEMBL4215477 0.89 TP53 (1.00) TP53LMNAPOLBKCNN3NPSR1
SCHEMBL4212697 0.86 KCNN3 (0.80) TP53LMNAPOLBKCNN3NPSR1
SCHEMBL25199209 0.86 TP53 (0.80) TP53LMNAPOLBKCNN3NPSR1
SCHEMBL25193575 0.86 KCNN3 (1.00) TP53LMNAPOLBKCNN3NPSR1
SCHEMBL4219187 0.86 TP53 (0.79) TP53LMNAPOLBKCNN3NPSR1
SCHEMBL4218566 0.84 LMNA (1.00) TP53LMNAPOLBKCNN3NPSR1
SCHEMBL4210667 0.84 BCL6 (0.64) TP53LMNAPOLBKCNN3NPSR1
SCHEMBL25192044 0.83 POLB (0.74) TP53LMNAPOLBKCNN3NPSR1
SCHEMBL25190242 0.82 KCNN3 (1.00) TP53LMNAPOLBKCNN3NPSR1

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-20090036475-A1 Pyrazolyl-Pyrimidines as Potassium Channel Modulating Agents and Their Medical Use NEUROSEARCH A/S (DK) 2009-02-05 — — US disclosed
EP-1863796-A1 PYRAZOLYL-PYRIMIDINES AS POTASSIUM CHANNEL MODULATING AGENTS AND THEIR MEDICAL USE NeuroSearch A/S (DK) 2007-12-12 — — EP disclosed
WO-2006100212-A1 PYRAZOLYL-PYRIMIDINES AS POTASSIUM CHANNEL MODULATING AGENTS AND THEIR MEDICAL USE NEUROSEARCH A/S (DK) 2006-09-28 — — 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-20090036475-A1 Pyrazolyl-Pyrimidines as Potassium Channel Modulating Agents and Their Medical Use KCND2, KCNJ2, KCNN3 TP53 1721/4885LMNA 2922/4885POLB 516/4885

“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.

Send feedback