SCHEMBL14434331

SCHEMBL14434331

Cc1c(Cl)nc(C(N)=O)nc1Cl

nearest known ligand 0.48

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.48
MAPK1 P28482 2/20 0.41
PDE10A Q9Y233 2/20 0.37
LMNA P02545 1/20 0.37
ALDH1A1 P00352 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
HTT P42858 2/20 0.33
KDM4E B2RXH2 1/20 0.33
MAPT P10636 2/20 0.33
CYP1A2 P05177 1/20 0.32
CYP3A4 P08684 1/20 0.32
TSHR P16473 1/20 0.32
SLC9A1 P19634 1/20 0.32
ALKBH5 Q6P6C2 1/20 0.32
FTO Q9C0B1 1/20 0.32
RAD52 P43351 1/20 0.31
SIRT6 Q8N6T7 1/20 0.30

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
SCHEMBL14434333 0.82 POLB (0.40) POLBMAPK1PDE10AALDH1A1SMN1; SMN2
SCHEMBL27462527 0.78 POLB (0.41) POLBMAPK1LMNAALDH1A1HTT
SCHEMBL14434338 0.78 SMN1; SMN2 (0.47) POLBMAPK1PDE10ALMNAALDH1A1
SCHEMBL28456316 0.75 MAPK1 (0.43) POLBMAPK1PDE10AALDH1A1SMN1; SMN2
SCHEMBL4161034 0.73 LMNA (0.38) POLBMAPK1LMNAHTTKDM4E
SCHEMBL14434341 0.73 NPSR1 (0.44) MAPK1PDE10ALMNAALDH1A1SMN1; SMN2
SCHEMBL11949168 0.73 POLB (0.41) POLBMAPK1PDE10ALMNAALDH1A1
SCHEMBL9704587 0.73 POLB (0.55) POLBMAPK1LMNAALDH1A1SMN1; SMN2
SCHEMBL1088195 0.73 MAPK1 (0.48) POLBMAPK1LMNAALDH1A1HTT
SCHEMBL28396458 0.72 LMNA (0.52) POLBMAPK1LMNAALDH1A1HTT

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-20070179125-A1 Aminopyrimidines useful as kinase inhibitors VERTEX PHARMACEUTICALS INCORPORATED 2007-08-02 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-20070179125-A1 Aminopyrimidines useful as kinase inhibitors ABL1, MAP3K5, MAP3K20 POLB 782/4885MAPK1 214/4885PDE10A 2061/4885

“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.