SCHEMBL26856995

SCHEMBL26856995

Nc1nc2ccc(-c3csc(C(=O)NCC4COCCO4)c3)cn2n1

nearest known ligand 0.40

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ MMP12 P39900 5/20 0.40
▸ PIK3CA P42336 2/20 0.39
▸ PIK3CG P48736 2/20 0.39
▸ KDM4E B2RXH2 1/20 0.38
▸ METTL3 Q86U44 1/20 0.37
▸ MMP2 P08253 1/20 0.36
▸ MMP8 P22894 1/20 0.36
▸ MMP13 P45452 1/20 0.36
▸ TTK P33981 2/20 0.35
▸ PIK3CD O00329 1/20 0.35
▸ PIK3CB P42338 1/20 0.35
▸ GRM4 Q14833 1/20 0.34

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
SCHEMBL26856936 0.90 HPGD (0.47) KDM4E
SCHEMBL26856993 0.89 HPGD (0.44) MMP12PIK3CAPIK3CGKDM4E
SCHEMBL26856997 0.89 MAPK8 (0.44) MMP12PIK3CAPIK3CGMETTL3MMP2
SCHEMBL26856958 0.87 PIK3CA (0.42) MMP12PIK3CAPIK3CGMETTL3MMP2
SCHEMBL26857005 0.86 ACKR3 (0.42) MMP12PIK3CAPIK3CGKDM4EMMP2
SCHEMBL26856933 0.86 PIK3CA (0.46) MMP12PIK3CAPIK3CGMMP2MMP8
SCHEMBL26856937 0.83 PIK3CG (0.48) MMP12PIK3CAPIK3CGKDM4EMETTL3
SCHEMBL26856930 0.82 PIK3CG (0.47) MMP12PIK3CAPIK3CGKDM4EMETTL3
SCHEMBL26856929 0.81 MAPK8 (0.41) MMP12PIK3CAPIK3CGPIK3CDPIK3CB
SCHEMBL26857317 0.81 MAPK10 (0.42) MMP12PIK3CAPIK3CGTTKPIK3CD

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 MMP12 4866/4885PIK3CA 841/4885PIK3CG 690/4885

“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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