SCHEMBL26856949

SCHEMBL26856949

Nc1nc2ccc(-c3csc(C(=O)NCc4cccc(Cl)c4)c3)cn2n1

nearest known ligand 0.47

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ MAPK1 P28482 4/20 0.47
▸ MMP12 P39900 1/20 0.42
▸ ROCK1 Q13464 2/20 0.42
▸ ROCK2 O75116 1/20 0.42
▸ ADORA2A P29274 2/20 0.42
▸ ADORA1 P30542 2/20 0.42
▸ PIK3CD O00329 1/20 0.42
▸ PIK3CG P48736 1/20 0.42
▸ MAOB P27338 1/20 0.41
▸ ADORA3 P0DMS8 1/20 0.41
▸ ADORA2B P29275 1/20 0.41
▸ CNR1 P21554 1/20 0.40
▸ FYN P06241 1/20 0.40
▸ CNR2 P34972 1/20 0.40
▸ NPC1 O15118 1/20 0.39
▸ MAPT P10636 2/20 0.39
▸ ALDH1A1 P00352 1/20 0.39

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
SCHEMBL26857050 0.90 MMP12 (0.47) MAPK1MMP12PIK3CDPIK3CGMAPT
SCHEMBL26856882 0.90 MMP12 (0.53) MAPK1MMP12ROCK1ROCK2ADORA2A
SCHEMBL26857017 0.89 MAPK1 (0.46) MAPK1MMP12ROCK1ROCK2ADORA2A
SCHEMBL26856951 0.89 ADORA2A (0.43) MAPK1MMP12ROCK1ROCK2ADORA2A
SCHEMBL26857184 0.88 MMP12 (0.44) MAPK1MMP12ROCK1ROCK2PIK3CD
SCHEMBL26856914 0.87 MAPK1 (0.49) MAPK1ROCK1ROCK2ADORA2AADORA1
SCHEMBL26857074 0.87 TTK (0.43) MMP12ROCK1ROCK2ADORA2AADORA1
SCHEMBL26857000 0.86 MAPK1 (0.46) MAPK1MMP12MAOB
SCHEMBL26857172 0.86 MMP12 (0.40) MAPK1MMP12ROCK1ROCK2PIK3CD
SCHEMBL26856987 0.85 PIK3CG (0.46) MAPK1MMP12ROCK1ROCK2ADORA2A

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 MAPK1 3172/4885MMP12 4866/4885ROCK1 3232/4885

“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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