SCHEMBL4452073

SCHEMBL4452073

CS(=O)(=O)c1ccc(-c2cnc(NCC3CCN(C(=O)O)CC3)nc2)cc1

nearest known ligand 0.49

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
VCP P55072 2/20 0.49
GPR119 Q8TDV5 1/20 0.46
CKS1B P61024 1/20 0.46
SKP1 P63208 1/20 0.46
SKP2 Q13309 1/20 0.46
GRIN2B Q13224 10/20 0.44
JAK2 O60674 1/20 0.44
JAK1 P23458 1/20 0.44
JAK3 P52333 1/20 0.44
LRRK2 Q5S007 1/20 0.43
PTGS2 P35354 2/20 0.43
PTGS1 P23219 1/20 0.42
CYP11B2 P19099 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
SCHEMBL3978507 0.88 USP30 (0.47) VCPGPR119CKS1BSKP1SKP2
SCHEMBL4455848 0.88 GRIN2B (0.52) GPR119GRIN2B
SCHEMBL4457043 0.87 GPR119 (0.47) VCPGPR119CKS1BSKP1SKP2
SCHEMBL4460035 0.86 GPR119 (0.54) GPR119GRIN2B
SCHEMBL5077936 0.86 GPR119 (0.63) GPR119
SCHEMBL4451965 0.85 GRIN2B (0.68) GRIN2B
SCHEMBL3983111 0.82 VCP (0.47) VCPGPR119CKS1BSKP1SKP2
SCHEMBL4049787 0.82 TPH1 (0.49) VCPGPR119CKS1BSKP1SKP2
SCHEMBL4457000 0.81 PTGS2 (0.44) GPR119CKS1BSKP1SKP2GRIN2B
SCHEMBL27900321 0.81 ALDH1A1 (0.49) VCPGPR119CKS1BSKP1SKP2

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2059517-A1 PYRIMIDINE COMPOUNDS FOR TREATING GPR119 RELATED DISORDERS Biovitrum AB (publ) (SE) 2009-05-20 EP claimed
US-20080103141-A1 New compounds BIOVITRUM (SE) 2008-05-01 US claimed
WO-2008025800-A1 PYRIMIDINE COMPOUNDS FOR TREATING GPR119 RELATED DISORDERS BIOVITRUM AB (PUBL) (SE) 2008-03-06 WO claimed
EP-2059517-A1 PYRIMIDINE COMPOUNDS FOR TREATING GPR119 RELATED DISORDERS Biovitrum AB (publ) (SE) 2009-05-20 EP disclosed
US-20080103141-A1 New compounds BIOVITRUM (SE) 2008-05-01 US disclosed
WO-2008025800-A1 PYRIMIDINE COMPOUNDS FOR TREATING GPR119 RELATED DISORDERS BIOVITRUM AB (PUBL) (SE) 2008-03-06 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-20080103141-A1 New compounds GPR119, GPR3, GPR4 VCP 3919/4885GPR119 1/4885CKS1B 2348/4885

“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.