SCHEMBL13615339

SCHEMBL13615339

Cc1cc(C(C)(C)C)ccc1NS(=O)(=O)c1ccc(C#N)cc1Cl

nearest known ligand 0.52

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
SLC22A12 Q96S37 2/20 0.52
HSD11B1 P28845 1/20 0.46
CCR9 P51686 6/20 0.46
CSNK1D P48730 1/20 0.46
MCL1 Q07820 3/20 0.43
ACLY P53396 2/20 0.43
PIK3C3 Q8NEB9 1/20 0.41
PDK1 Q15118 1/20 0.41
PDK2 Q15119 1/20 0.41
PDK3 Q15120 1/20 0.41
PDK4 Q16654 1/20 0.41
HSD17B2 P37059 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.40

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
SCHEMBL4650351 0.85 TRPV4 (0.51) SLC22A12MCL1
SCHEMBL16325840 0.83 SLC22A12 (0.47) SLC22A12HSD11B1ACLYPIK3C3L3MBTL1
SCHEMBL13852847 0.83 ACLY (0.53) HSD11B1CCR9MCL1ACLYHSD17B2
SCHEMBL27761878 0.81 SLC22A12 (0.58) SLC22A12MCL1ACLYL3MBTL1
SCHEMBL13852834 0.81 MCL1 (0.59) MCL1ACLYHSD17B2
SCHEMBL13615340 0.81 MCL1 (0.60) MCL1ACLYL3MBTL1
SCHEMBL13852823 0.79 MCL1 (0.59) HSD11B1MCL1ACLYHSD17B2L3MBTL1
SCHEMBL13615230 0.77 SLC22A12 (0.48) SLC22A12HSD11B1PIK3C3
SCHEMBL13615244 0.76 NHERF1 (0.65) HSD11B1MCL1ACLYHSD17B2L3MBTL1
SCHEMBL4898138 0.75 SLC22A12 (0.57) SLC22A12HSD11B1CCR9MCL1ACLY

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-20090275593-A1 3 Substituted N-(aryl- or heteroaryl)-pyrazolo[1,5-a]pyrimidines as Kinase Inhibitors NOVARTIS AG 2009-11-05 US disclosed
US-20090118277-A1 3 Unsubstituted N-(aryl- or heteroaryl)-pyrazolo[1,5-a]pyrimidines as Kinase Inhibitors NOVARTIS AG 2009-05-07 US disclosed
US-20090118277-A1 3 Unsubstituted N-(aryl- or heteroaryl)-pyrazolo[1,5-a]pyrimidines as Kinase Inhibitors NOVARTIS AG 2009-05-07 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 (2 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-20090118277-A1 3 Unsubstituted N-(aryl- or heteroaryl)-pyrazolo[1,5-a]pyrimidines as Kinase Inhibitors TIE1, TEK, MATK SLC22A12 4663/4885HSD11B1 4693/4885CCR9 3942/4885
US-20090275593-A1 3 Substituted N-(aryl- or heteroaryl)-pyrazolo[1,5-a]pyrimidines as Kinase Inhibitors TIE1, TEK, MATK SLC22A12 4627/4885HSD11B1 4710/4885CCR9 3132/4885

“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.