SCHEMBL25298378

SCHEMBL25298378

C[C@H]1COc2nc(C(=O)N3CC(O)C3)c(Cc3ccc(F)cc3)cc2N1

nearest known ligand 0.35

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ ADORA3 P0DMS8 1/20 0.35
▸ ADORA2A P29274 1/20 0.35
▸ ADORA2B P29275 1/20 0.35
▸ HCRTR1 O43613 3/20 0.34
▸ HCRTR2 O43614 3/20 0.34
▸ XIAP P98170 2/20 0.33
▸ BIRC2 Q13490 2/20 0.33
▸ CNR2 P34972 1/20 0.33
▸ HSD11B1 P28845 2/20 0.32
▸ HSP90AA1 P07900 1/20 0.32
▸ KCNH2 Q12809 1/20 0.32
▸ CCNC P24863 2/20 0.32
▸ CDK8 P49336 2/20 0.32
▸ TDP1 Q9NUW8 1/20 0.32
▸ GRIN2B Q13224 1/20 0.32
▸ MLNR O43193 1/20 0.31
▸ CYP3A4 P08684 1/20 0.31
▸ GRM2 Q14416 4/20 0.31

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
SCHEMBL25298379 1.00 ADORA3 (0.35) ADORA3ADORA2AADORA2BHCRTR1HCRTR2
SCHEMBL25301087 0.89 TMEM97 (0.37) HCRTR1HCRTR2CNR2MLNRCYP3A4
SCHEMBL25301086 0.89 TMEM97 (0.37) HCRTR1HCRTR2CNR2MLNRCYP3A4
SCHEMBL25289846 0.88 DPP4 (0.38) ADORA2AADORA2BCNR2KCNH2GRIN2B
SCHEMBL25251080 0.88 DPP4 (0.38) ADORA2AADORA2BCNR2KCNH2GRIN2B
SCHEMBL25251715 0.88 DPP4 (0.38) ADORA2AADORA2BCNR2KCNH2GRIN2B
SCHEMBL25301093 0.88 KMT2A (0.39) CNR2GRM2
SCHEMBL25301094 0.88 KMT2A (0.39) CNR2GRM2
SCHEMBL25290408 0.88 HRH4 (0.38) CNR2HSP90AA1
SCHEMBL25253586 0.88 HRH4 (0.38) CNR2HSP90AA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12583866-B2 Pyrido[2,3-b][1,4]oxazines or tetrahydropyrido[2,3-b][1,4]oxazepines as IAP antagonists BEONE MEDICINES I GMBH (CH) 2026-03-24 — — US disclosed
US-20230219975-A1 PYRIDO[2,3-B][1,4]OXAZINES OR TETRAHYDROPYRIDO[2,3-B][1,4]OXAZEPINES AS IAP ANTAGONISTS BEONE MEDICINES I GMBH (CH) 2023-07-13 — — US disclosed
US-20230219975-A1 PYRIDO[2,3-B][1,4]OXAZINES OR TETRAHYDROPYRIDO[2,3-B][1,4]OXAZEPINES AS IAP ANTAGONISTS BEONE MEDICINES I GMBH (CH) 2023-07-13 — — US disclosed
US-20230219975-A1 PYRIDO[2,3-B][1,4]OXAZINES OR TETRAHYDROPYRIDO[2,3-B][1,4]OXAZEPINES AS IAP ANTAGONISTS BEONE MEDICINES I GMBH (CH) 2023-07-13 — — US disclosed
EP-4161937-A1 PYRIDO[2,3-B] [1,4] OXAZINES OR TETRAHYDROPYRIDO[2,3-B][1,4] OXAZEPINES AS IAP ANTAGONISTS BeiGene, Ltd. (KY) 2023-04-12 — — 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 (2 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-12583866-B2 Pyrido[2,3-b][1,4]oxazines or tetrahydropyrido[2,3-b][1,4]oxazepines as IAP antagonists BIRC2, BIRC3, BIRC5 ADORA3 2904/4885ADORA2A 2076/4885ADORA2B 1859/4885
US-20230219975-A1 PYRIDO[2,3-B][1,4]OXAZINES OR TETRAHYDROPYRIDO[2,3-B][1,4]OXAZEPINES AS IAP ANTAGONISTS BIRC2, BIRC3, API5 ADORA3 2148/4885ADORA2A 1281/4885ADORA2B 1694/4885

“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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