SCHEMBL25252267

SCHEMBL25252267

CC(=O)Nc1cc(-c2cc3nccnc3n2COCC[Si](C)(C)C)ccn1

nearest known ligand 0.40

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PIK3C3 Q8NEB9 11/20 0.40
MAPK14 Q16539 6/20 0.39
AAK1 Q2M2I8 2/20 0.39
MAPK10 P53779 1/20 0.39
RIPK2 O43353 1/20 0.39
CYP3A4 P08684 1/20 0.38

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
SCHEMBL25207714 0.80 MAPK14 (0.41) MAPK14AAK1MAPK10CYP3A4
SCHEMBL15051277 0.80 AAK1 (0.43) PIK3C3MAPK14AAK1CYP3A4
SCHEMBL30365610 0.80 MAPK14 (0.41) MAPK14AAK1MAPK10CYP3A4
SCHEMBL25217236 0.77 TGFBR1 (0.40) MAPK14MAPK10
SCHEMBL30365434 0.77 TGFBR1 (0.40) MAPK14MAPK10
SCHEMBL15051361 0.76 NR3C2 (0.42) PIK3C3AAK1MAPK10CYP3A4
SCHEMBL2317159 0.76 TDP1 (0.39)
SCHEMBL15050234 0.76 MAPK14 (0.41) PIK3C3MAPK14AAK1MAPK10CYP3A4
SCHEMBL15050692 0.74 AAK1 (0.41) PIK3C3MAPK14AAK1MAPK10CYP3A4
SCHEMBL15051389 0.72 MAPK14 (0.37) PIK3C3MAPK14AAK1MAPK10CYP3A4

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
EP-4509122-A2 SUBSTITUTED HETEROCYCLIC COMPOUNDS AND THERAPEUTIC USES THEREOF Bayer Aktiengesellschaft (DE) 2025-02-19 EP disclosed
EP-4188930-B1 SUBSTITUTED HETEROCYCLIC COMPOUNDS AND THERAPEUTIC USES THEREOF BAYER AG (DE) 2024-10-23 EP disclosed
US-20230391769-A1 SUBSTITUTED HETEROCYCLIC COMPOUNDS AND THERAPEUTIC USES THEREOF BAYER AKTIENGESELLSCHAFT (DE) 2023-12-07 US disclosed
EP-4188930-A1 SUBSTITUTED HETEROCYCLIC COMPOUNDS AND THERAPEUTIC USES THEREOF Bayer Aktiengesellschaft (DE) 2023-06-07 EP 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-20230391769-A1 SUBSTITUTED HETEROCYCLIC COMPOUNDS AND THERAPEUTIC USES THEREOF CYP11B2, SDHA, UGT2B7 PIK3C3 1806/4885MAPK14 3249/4885AAK1 4639/4885

“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.