SCHEMBL25251476

SCHEMBL25251476

Cc1nc(Cl)c(Br)cc1Br

nearest known ligand 0.39

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
NQO2 P16083 1/20 0.39
LMNA P02545 2/20 0.38
HPGD P15428 2/20 0.38
ALDH1A1 P00352 1/20 0.38
APOBEC3G Q9HC16 1/20 0.38
NPSR1 Q6W5P4 2/20 0.31
HTT P42858 2/20 0.31
PRNP P04156 1/20 0.31
NOD2 Q9HC29 1/20 0.31
CYP1A2 P05177 2/20 0.31
CYP2C9 P11712 2/20 0.31
CYP2C19 P33261 2/20 0.31
CYP2D6 P10635 1/20 0.30
RXFP1 Q9HBX9 1/20 0.30

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
SCHEMBL30309241 1.00 NQO2 (0.39) NQO2LMNAHPGDALDH1A1APOBEC3G
SCHEMBL15195547 0.83 NQO2 (0.33) NQO2LMNAHPGDALDH1A1NPSR1
SCHEMBL20361147 0.83 LMNA (0.37) NQO2LMNAHPGDALDH1A1APOBEC3G
SCHEMBL30631413 0.83 NQO2 (0.33) NQO2LMNAHPGDALDH1A1NPSR1
SCHEMBL17408873 0.83 ALDH1A1 (0.37) NQO2LMNAHPGDALDH1A1APOBEC3G
SCHEMBL2258481 0.81 NQO2 (0.46) NQO2LMNAHPGDALDH1A1APOBEC3G
SCHEMBL19068130 0.79 HPGD (0.48) NQO2LMNAHPGDALDH1A1NPSR1
SCHEMBL16797274 0.79 POLB (0.34) NQO2LMNAHPGDALDH1A1APOBEC3G
SCHEMBL1558796 0.79 LMNA (0.39) NQO2LMNAHPGDALDH1A1APOBEC3G
SCHEMBL15972382 0.79 KEAP1 (0.38) NQO2LMNAHPGDALDH1A1APOBEC3G

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
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
CN-118047654-A Process for preparing aryl halides starting from aromatic amines 黑龙江立科新材料有限公司 2024-05-17 CN 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
CN-115916790-A Pyrido [2,3-b ] [1,4] oxazines or tetrahydropyrido [2,3-b ] [1,4] oxazepines as IAP antagonists 百济神州有限公司 2023-04-04 CN 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 NQO2 3709/4885LMNA 810/4885HPGD 2583/4885
US-20230219975-A1 PYRIDO[2,3-B][1,4]OXAZINES OR TETRAHYDROPYRIDO[2,3-B][1,4]OXAZEPINES AS IAP ANTAGONISTS BIRC2, BIRC3, API5 NQO2 2476/4885LMNA 738/4885HPGD 921/4885

“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.