SCHEMBL25811427

SCHEMBL25811427

CC[C@@H](COc1ncc(Br)cc1Br)NC(=O)OC(C)(C)C

nearest known ligand 0.47

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
AAK1 Q2M2I8 9/20 0.47
SYK P43405 2/20 0.38
SMN1; SMN2 Q16637 1/20 0.35
ATM Q13315 1/20 0.35
LMNA P02545 1/20 0.35
ALOX15 P16050 1/20 0.35
TSHR P16473 1/20 0.35
HTT P42858 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
ALDH1A1 P00352 1/20 0.35
MAPT P10636 1/20 0.35
CTSS P25774 2/20 0.34
CTSK P43235 2/20 0.34
CTSB P07858 1/20 0.34
SCN9A Q15858 1/20 0.34
EGFR P00533 1/20 0.34
TRPA1 O75762 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
SCHEMBL28995608 1.00 AAK1 (0.47) AAK1SYKSMN1; SMN2ATMLMNA
SCHEMBL25807450 0.89 AAK1 (0.61) AAK1LMNAMAPTSCN9AEGFR
SCHEMBL25811104 0.86 AAK1 (0.50) AAK1CTSSCTSKCTSBSCN9A
SCHEMBL25811463 0.85 ATM (0.53) AAK1ATMCTSSCTSKCTSB
SCHEMBL28995695 0.85 ATM (0.53) AAK1ATMCTSSCTSKCTSB
SCHEMBL25300548 0.84 SCN9A (0.37) AAK1SMN1; SMN2LMNAALOX15TSHR
SCHEMBL25252925 0.84 SCN9A (0.37) AAK1SMN1; SMN2LMNAALOX15TSHR
SCHEMBL28995644 0.82 PPARA (0.50) AAK1SYKATMCTSSCTSK
SCHEMBL30491809 0.82 PPARA (0.50) AAK1SYKATMCTSSCTSK
SCHEMBL25807391 0.82 PPARA (0.50) AAK1SYKATMCTSSCTSK

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 3 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

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 AAK1 506/4885SYK 4670/4885SMN1; SMN2 170/4885
US-20230219975-A1 PYRIDO[2,3-B][1,4]OXAZINES OR TETRAHYDROPYRIDO[2,3-B][1,4]OXAZEPINES AS IAP ANTAGONISTS BIRC2, BIRC3, API5 AAK1 293/4885SYK 4849/4885SMN1; SMN2 419/4885

“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.