SCHEMBL25501004

SCHEMBL25501004

COc1ccnc(C(=O)Nc2nc3ccc(Oc4cccnc4C)nc3s2)c1O

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BUB1 O43683 1/20 0.41
ABL1 P00519 1/20 0.39
RAB9A P51151 4/20 0.38
NPC1 O15118 3/20 0.38
PKM P14618 1/20 0.38
PAX8 Q06710 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
MAP4K4 O95819 1/20 0.38
KDM4E B2RXH2 2/20 0.38
HTR2C P28335 4/20 0.38
MEN1 O00255 3/20 0.37
KMT2A Q03164 3/20 0.37
ALDH1A1 P00352 2/20 0.37
MAPT P10636 2/20 0.37
TP53 P04637 1/20 0.37
HPGD P15428 1/20 0.37
NPSR1 Q6W5P4 1/20 0.37
HSD17B10 Q99714 1/20 0.37
LMNA P02545 1/20 0.37
PDGFRB P09619 1/20 0.37

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
SCHEMBL31683921 0.91 ABL1 (0.43) ABL1RAB9ANPC1PKMPAX8
SCHEMBL23719992 0.91 ABL1 (0.43) ABL1RAB9ANPC1PKMPAX8
SCHEMBL31683885 0.90 ROCK2 (0.39) BUB1ABL1RAB9ANPC1PKM
SCHEMBL23719997 0.90 ROCK2 (0.39) BUB1ABL1RAB9ANPC1PKM
SCHEMBL25500996 0.90 ABL1 (0.42) BUB1ABL1RAB9ANPC1PKM
SCHEMBL31683882 0.88 ABL1 (0.41) ABL1RAB9ANPC1PKMPAX8
SCHEMBL23719991 0.88 ABL1 (0.41) ABL1RAB9ANPC1PKMPAX8
SCHEMBL21186103 0.86 HCK (0.45) ABL1RAB9ANPC1PKMPAX8
SCHEMBL25501079 0.85 HCRTR1 (0.36) ABL1RAB9ANPC1KDM4EMEN1
SCHEMBL21186127 0.85 NPC1 (0.45) ABL1RAB9ANPC1MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230151023-A1 PYRIDO[2,3-E]OXAZINE DERIVATIVES AS AGRICULTURAL CHEMICALS GLOBACHEM NV (BE) 2023-05-18 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 (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-20230151023-A1 PYRIDO[2,3-E]OXAZINE DERIVATIVES AS AGRICULTURAL CHEMICALS PNPO, HPD, PDXK BUB1 341/4885ABL1 3454/4885RAB9A 4522/4885

“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.