SCHEMBL26857043

SCHEMBL26857043

Nc1nc2ccc(-c3csc(C(=O)NCc4c(F)cccc4F)c3)cn2n1

nearest known ligand 0.40

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ ADORA2A P29274 4/20 0.40
▸ MMP12 P39900 1/20 0.39
▸ PIK3CD O00329 3/20 0.39
▸ PIK3CG P48736 3/20 0.39
▸ RIPK1 Q13546 6/20 0.38
▸ PIK3CA P42336 1/20 0.37
▸ PIK3CB P42338 1/20 0.37
▸ ULK1 O75385 2/20 0.37
▸ TTK P33981 1/20 0.36
▸ KLKB1 P03952 1/20 0.36
▸ MAPK1 P28482 1/20 0.36

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
SCHEMBL26857017 0.87 MAPK1 (0.46) ADORA2AMMP12PIK3CDPIK3CGULK1
SCHEMBL26857176 0.87 POLB (0.40) MMP12PIK3CDPIK3CGPIK3CATTK
SCHEMBL26857000 0.86 MAPK1 (0.46) MMP12MAPK1
SCHEMBL26857044 0.86 MMP12 (0.42) MMP12PIK3CDPIK3CGPIK3CAPIK3CB
SCHEMBL26856882 0.85 MMP12 (0.53) ADORA2AMMP12PIK3CDPIK3CGPIK3CB
SCHEMBL26857155 0.84 TTK (0.43) MMP12PIK3CDPIK3CGTTKMAPK1
SCHEMBL26856951 0.83 ADORA2A (0.43) ADORA2AMMP12PIK3CDPIK3CGTTK
SCHEMBL26856949 0.83 MAPK1 (0.47) ADORA2AMMP12PIK3CDPIK3CGMAPK1
SCHEMBL26857148 0.83 MARK3 (0.46) MMP12PIK3CDPIK3CGPIK3CAPIK3CB
SCHEMBL26857184 0.83 MMP12 (0.44) MMP12PIK3CDPIK3CGTTKMAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230382904-A1 SUBSTITUTED 4-([1,2,4]TRIAZOLO[1,5-a]PYRIDIN-6-YL)THIOPHENE-2-CARBOXAMIDE DERIVATIVES AND USE THEREOF BAYER AKTIENGESELLSCHAFT (DE) 2023-11-30 — — US disclosed
US-20230382904-A1 SUBSTITUTED 4-([1,2,4]TRIAZOLO[1,5-a]PYRIDIN-6-YL)THIOPHENE-2-CARBOXAMIDE DERIVATIVES AND USE THEREOF BAYER AKTIENGESELLSCHAFT (DE) 2023-11-30 — — 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-20230382904-A1 SUBSTITUTED 4-([1,2,4]TRIAZOLO[1,5-a]PYRIDIN-6-YL)THIOPHENE-2-CARBOXAMIDE DERIVATIVES AND USE THEREOF SNCA, PSEN2, PARK7 ADORA2A 387/4885MMP12 4866/4885PIK3CD 1085/4885

“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.

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