SCHEMBL5653944

SCHEMBL5653944

CS(=O)(=O)N1CCN(CCCNc2nc(N)ncc2-c2cccc(Cl)c2)CC1

nearest known ligand 0.45

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
IRAK1 P51617 7/20 0.45
DHFR P00374 1/20 0.43
IRAK4 Q9NWZ3 6/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
FGFR1 P11362 5/20 0.42
KDR P35968 2/20 0.42
ADORA2A P29274 2/20 0.41
ADORA1 P30542 1/20 0.41
PDE4B Q07343 1/20 0.41
PDE4D Q08499 1/20 0.41
PIK3CA P42336 1/20 0.41
MTOR P42345 1/20 0.41

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
SCHEMBL4101836 0.89 FGFR1 (0.52) DHFRIRAK4SMN1; SMN2FGFR1KDR
SCHEMBL4118866 0.87 DHFR (0.50) DHFRIRAK4SMN1; SMN2FGFR1KDR
SCHEMBL4100252 0.85 IRAK4 (0.49) IRAK1DHFRIRAK4SMN1; SMN2FGFR1
SCHEMBL3978332 0.84 SMN1; SMN2 (0.59) IRAK1DHFRIRAK4SMN1; SMN2FGFR1
SCHEMBL4082424 0.84 IRAK4 (0.48) IRAK1DHFRIRAK4SMN1; SMN2KDR
SCHEMBL4107262 0.83 DHFR (0.50) IRAK1DHFRIRAK4SMN1; SMN2FGFR1
SCHEMBL4107081 0.83 IRAK4 (0.60) IRAK1DHFRIRAK4SMN1; SMN2KDR
SCHEMBL4113403 0.83 KDR (0.48) IRAK1DHFRIRAK4SMN1; SMN2FGFR1
SCHEMBL4110576 0.81 DHFR (0.48) IRAK1DHFRIRAK4SMN1; SMN2ADORA2A
SCHEMBL4107698 0.81 DHFR (0.46) IRAK1DHFRIRAK4SMN1; SMN2FGFR1

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-20070293494-A1 2-Anilino-4-(Heterocyclic) Amino-Pyrimidines DJUNG JANE F 2007-12-20 US claimed

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-20070293494-A1 2-Anilino-4-(Heterocyclic) Amino-Pyrimidines PRKCA, PRKCG, PRKCH IRAK1 1856/4885DHFR 1013/4885IRAK4 1916/4885

“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.