SCHEMBL23508347

SCHEMBL23508347

CS(=O)(=O)c1nc(NCc2nc3cc(Cl)ccc3[nH]2)n2ncc(Br)c2n1

nearest known ligand 0.34

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
GSK3B P49841 3/20 0.34
HRH4 Q9H3N8 3/20 0.33
HSD17B10 Q99714 1/20 0.33
PTGS2 P35354 1/20 0.33
KLK1 P06870 1/20 0.32
KLK5 Q9Y337 1/20 0.32
SRPK2 P78362 1/20 0.32
SRPK1 Q96SB4 1/20 0.32
CDK2 P24941 3/20 0.31
ABL1 P00519 1/20 0.31
SRC P12931 1/20 0.31
PDE9A O76083 1/20 0.30
CSNK1D P48730 1/20 0.30
CSNK1E P49674 1/20 0.30
IDH1 O75874 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
SCHEMBL23497516 0.89 HSD17B10 (0.33) GSK3BHSD17B10CDK2
SCHEMBL23508128 0.89 MEN1 (0.34) GSK3BHSD17B10CDK2
SCHEMBL23497842 0.88 KLK1 (0.36) GSK3BHSD17B10KLK1KLK5PDE9A
SCHEMBL30012124 0.88 KLK1 (0.36) GSK3BHSD17B10KLK1KLK5PDE9A
SCHEMBL23497830 0.87 HSD17B10 (0.46) HSD17B10KLK1KLK5
SCHEMBL23508064 0.83 GSK3B (0.36) GSK3BHRH4PTGS2KLK1KLK5
SCHEMBL23508105 0.83 CDK2 (0.36) GSK3BHSD17B10CDK2
SCHEMBL23508254 0.82 CDK12 (0.40) CDK2CSNK1DCSNK1E
SCHEMBL23508346 0.82 PTGS2 (0.34) GSK3BHRH4PTGS2KLK1KLK5
SCHEMBL23508046 0.80 GSK3B (0.37) GSK3BCDK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230117034-A1 PYRAZOLOTRIAZINES BAYER AKTIENGESELLSCHAFT (DE) 2023-04-20 US disclosed
EP-4073072-A1 PYRAZOLOTRIAZINES Bayer Aktiengesellschaft (DE) 2022-10-19 EP disclosed
CN-115023427-A Pyrazolotriazines 拜耳公司 2022-09-06 CN disclosed
WO-2021116178-A1 PYRAZOLOTRIAZINES BAYER AKTIENGESELLSCHAFT (DE) 2021-06-17 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-20230117034-A1 PYRAZOLOTRIAZINES BRCA1, TPX2, CCND2 GSK3B 3545/4885HRH4 179/4885HSD17B10 2386/4885

“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.