SCHEMBL5577960

SCHEMBL5577960

NC(=O)c1nc2[nH]nc(-n3cncc3-c3ccccc3Cl)c2s1

nearest known ligand 0.36

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
GPBAR1 Q8TDU6 2/20 0.36
CHEK1 O14757 1/20 0.33
IKBKB O14920 2/20 0.32
PARP1 P09874 1/20 0.32
JAK2 O60674 1/20 0.32
IDO1 P14902 1/20 0.32
BACE1 P56817 2/20 0.31
CCNE2 O96020 1/20 0.31
CCNE1 P24864 1/20 0.31
CDK2 P24941 1/20 0.31
ALPL P05186 1/20 0.31
PAK1 Q13153 1/20 0.30
CSNK2A2 P19784 1/20 0.30
KDR P35968 1/20 0.30
PLK1 P53350 1/20 0.30
CSNK2B P67870 1/20 0.30
CSNK2A1 P68400 1/20 0.30
CHEK2 O96017 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
SCHEMBL5578051 0.87 DYRK1A (0.32)
SCHEMBL4753611 0.84 GPBAR1 (0.39) GPBAR1JAK2IDO1BACE1ALPL
SCHEMBL5577957 0.84 LIMK1 (0.44) GPBAR1IDO1CCNE2CCNE1CDK2
SCHEMBL5577951 0.83 GPBAR1 (0.39) GPBAR1IDO1CDK2ALPL
SCHEMBL5577933 0.82 PAK1 (0.35) GPBAR1CCNE1CDK2PAK1
SCHEMBL14454855 0.82 MEN1 (0.45)
SCHEMBL5578015 0.82 TERT (0.34) IDO1
SCHEMBL5577939 0.82 HSD11B1 (0.36) IKBKBPARP1JAK2CSNK2A2KDR
SCHEMBL5577954 0.81 GPBAR1 (0.39) GPBAR1IDO1
SCHEMBL14455002 0.81 LIMK1 (0.47) GPBAR1CCNE1CDK2

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-20070173488-A1 Pyrazolothiazole Protein Kinase Modulators SGX PHARMACEUTICALS, INC. (US) 2007-07-26 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-20070173488-A1 Pyrazolothiazole Protein Kinase Modulators MAP4K2, MAP4K5, MAP4K3 GPBAR1 1899/4885CHEK1 132/4885IKBKB 677/4885

“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.