SCHEMBL3262979

SCHEMBL3262979

O=C1COc2ccc(Cl)nc2N1

nearest known ligand 0.54

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
NR3C2 P08235 8/20 0.47
MMP12 P39900 1/20 0.42
NR3C1 P04150 1/20 0.42
ALDH1A1 P00352 3/20 0.41
KMT2A Q03164 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
PARP1 P09874 1/20 0.40
MAPT P10636 2/20 0.39
HPGD P15428 1/20 0.39
KCNH2 Q12809 1/20 0.39
MGLL Q99685 1/20 0.39

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
SCHEMBL655255 0.83 NR3C2 (0.47) NR3C2MMP12NR3C1ALDH1A1KMT2A
SCHEMBL21400859 0.79 NR3C2 (0.47) NR3C2MMP12NR3C1ALDH1A1KMT2A
SCHEMBL2489889 0.79 NR3C2 (0.50) NR3C2MMP12NR3C1ALDH1A1KMT2A
SCHEMBL592791 0.79 NR3C2 (0.47) NR3C2MMP12NR3C1ALDH1A1KMT2A
SCHEMBL4343340 0.79 NR3C2 (0.47) NR3C2MMP12NR3C1ALDH1A1KMT2A
SCHEMBL5367006 0.79 NR3C2 (0.47) NR3C2MMP12NR3C1ALDH1A1KMT2A
SCHEMBL29712026 0.79 NR3C2 (0.47) NR3C2MMP12NR3C1ALDH1A1KMT2A
SCHEMBL14476544 0.79 NR3C2 (0.44) NR3C2MMP12NR3C1ALDH1A1PARP1
SCHEMBL620088 0.77 NR3C2 (0.45) NR3C2MMP12NR3C1ALDH1A1KMT2A
SCHEMBL12235340 0.76 PARP1 (0.50) NR3C2MMP12NR3C1PARP1KCNH2

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-20210070772-A1 ANTI-BACTERIAL HETEROCYCLIC COMPOUNDS AND THEIR SYNTHESIS Bugworks Research, Inc. 2021-03-11 US disclosed
US-10912780-B2 Heterocyclic compounds useful as anti-bacterial agents and method for production thereof Bugworks Research, Inc. (US) 2021-02-09 US disclosed
US-20200085834-A1 HETEROCYCLIC COMPOUNDS USEFUL AS ANTI-BACTERIAL AGENTS AND METHOD FOR PRODUCTION THEREOF Bugworks Research, Inc. 2020-03-19 US disclosed
EP-2181996-A1 Aminopiperidine derivatives GLAXO GROUP LIMITED (GB) 2010-05-05 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 (3 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-20200085834-A1 HETEROCYCLIC COMPOUNDS USEFUL AS ANTI-BACTERIAL AGENTS AND METHOD FOR PRODUCTION THEREOF UROD, ALPI, HLA-A NR3C2 2682/4885MMP12 1264/4885NR3C1 4002/4885
US-20210070772-A1 ANTI-BACTERIAL HETEROCYCLIC COMPOUNDS AND THEIR SYNTHESIS HLA-B, BAX, REN NR3C2 1247/4885MMP12 1300/4885NR3C1 2578/4885
US-10912780-B2 Heterocyclic compounds useful as anti-bacterial agents and method for production thereof UROD, ALPI, HLA-A NR3C2 2682/4885MMP12 1264/4885NR3C1 4002/4885

“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.