SCHEMBL25301086

SCHEMBL25301086

C[C@H]1COc2nc(C(=O)N3CCCCC3)c(Cc3ccc(F)cc3)cc2N1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TMEM97 Q5BJF2 2/20 0.37
▸ NPC1 O15118 3/20 0.36
▸ RAB9A P51151 3/20 0.36
▸ DPP4 P27487 1/20 0.36
▸ CNR2 P34972 1/20 0.36
▸ SIGMAR1 Q99720 3/20 0.36
▸ CYP2D6 P10635 2/20 0.35
▸ CCR3 P51677 2/20 0.35
▸ MAPT P10636 2/20 0.35
▸ TP53 P04637 1/20 0.35
▸ HTT P42858 1/20 0.35
▸ KMT2A Q03164 2/20 0.35
▸ MEN1 O00255 1/20 0.35
▸ SMN1; SMN2 Q16637 2/20 0.34
▸ ALDH1A1 P00352 1/20 0.34
▸ KDM4E B2RXH2 1/20 0.34
▸ HPGD P15428 1/20 0.33
▸ MLNR O43193 1/20 0.33
▸ CYP3A4 P08684 1/20 0.33
▸ HCRTR1 O43613 1/20 0.33

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
SCHEMBL25301087 1.00 TMEM97 (0.37) TMEM97NPC1RAB9ADPP4CNR2
SCHEMBL25290408 0.92 HRH4 (0.38) CNR2CYP2D6CCR3HTTSMN1; SMN2
SCHEMBL25253586 0.92 HRH4 (0.38) CNR2CYP2D6CCR3HTTSMN1; SMN2
SCHEMBL25301093 0.92 KMT2A (0.39) NPC1RAB9ACNR2MAPTKMT2A
SCHEMBL25301094 0.92 KMT2A (0.39) NPC1RAB9ACNR2MAPTKMT2A
SCHEMBL25295511 0.90 CNR2 (0.40) CNR2KMT2AMEN1MLNRCYP3A4
SCHEMBL25295512 0.90 CNR2 (0.40) CNR2KMT2AMEN1MLNRCYP3A4
SCHEMBL25298378 0.89 ADORA3 (0.35) CNR2MLNRCYP3A4HCRTR1HCRTR2
SCHEMBL25298379 0.89 ADORA3 (0.35) CNR2MLNRCYP3A4HCRTR1HCRTR2
SCHEMBL25251715 0.88 DPP4 (0.38) DPP4CNR2CYP2D6SMN1; SMN2ALDH1A1

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 TMEM97 1130/4885NPC1 3029/4885RAB9A 3690/4885
US-20230219975-A1 PYRIDO[2,3-B][1,4]OXAZINES OR TETRAHYDROPYRIDO[2,3-B][1,4]OXAZEPINES AS IAP ANTAGONISTS BIRC2, BIRC3, API5 TMEM97 2211/4885NPC1 4670/4885RAB9A 4229/4885

“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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