SCHEMBL22122693

SCHEMBL22122693

[N-]=[N+]=NCc1ccc(N)cn1

nearest known ligand 0.36

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 1/20 0.36
▸ ALDH1A1 P00352 1/20 0.36
▸ ADRA2A P08913 2/20 0.35
▸ ADRA2B P18089 2/20 0.35
▸ ADRA2C P18825 2/20 0.35
▸ CA12 O43570 1/20 0.32
▸ CA1 P00915 1/20 0.32
▸ CA2 P00918 1/20 0.32
▸ CA4 P22748 1/20 0.32
▸ CA6 P23280 1/20 0.32
▸ CA5A P35218 1/20 0.32
▸ CA7 P43166 1/20 0.32
▸ CA9 Q16790 1/20 0.32
▸ CA13 Q8N1Q1 1/20 0.32
▸ CA14 Q9ULX7 1/20 0.32
▸ TLR8 Q9NR97 1/20 0.30
▸ TLR7 Q9NYK1 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
SCHEMBL15409988 0.79 KDM4E (0.37) KDM4EALDH1A1TLR8TLR7
SCHEMBL16560329 0.79 CCR1 (0.40) KDM4EALDH1A1ADRA2AADRA2BADRA2C
SCHEMBL15856196 0.78 GBA1 (0.38) KDM4EALDH1A1ADRA2AADRA2BADRA2C
SCHEMBL13878887 0.78 HTR2C (0.37) KDM4EALDH1A1
SCHEMBL16166585 0.78 KDM4E (0.36) KDM4EALDH1A1ADRA2AADRA2BADRA2C
SCHEMBL14948664 0.75 HRH3 (0.43) KDM4EALDH1A1TLR8TLR7
SCHEMBL27934647 0.75 KDM4E (0.37) KDM4EALDH1A1
SCHEMBL14945527 0.75 ESR1 (0.34) KDM4EALDH1A1TLR8TLR7
SCHEMBL29413990 0.75 NNMT (0.46) KDM4E
SCHEMBL14270180 0.75 CA2 (0.44) KDM4EALDH1A1CA12CA1CA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12139614-B2 Photoactivatable fluorescent dyes with hydrophilic caging groups and their use MAX-PLANCK-GESELLSCHAFT ZUR FOERDERUNG DER WISSENSCHAFTEN E. V. (DE) 2024-11-12 — — US disclosed
US-20240300896-A1 HETEROCYCLIC AZIDE UNITS AND THEIR USE IN POLYMER COATINGS ILLUMINA CAMBRIDGE LIMITED (GB) 2024-09-12 — — US disclosed
US-11999696-B2 Heterocyclic azide units and their use in polymer coatings ILLUMINA CAMBRIDGE LIMITED (GB) 2024-06-04 — — US disclosed
CN-112672996-B Heterocyclic azide units and their use in polymeric coatings 伊鲁米纳剑桥有限公司 2024-01-05 — — CN disclosed
US-20220064452-A1 PHOTOACTIVATABLE FLUORESCENT DYES WITH HYDROPHILIC CAGING GROUPS AND THEIR USE MAX-PLANCK-GESELLSCHAFT ZUR FOERDERUNG DER WISSENSCHAFTEN E. V. (DE) 2022-03-03 — — US disclosed
EP-3960817-A1 PHOTOACTIVATABLE FLUORESCENT DYES WITH HYDROPHILIC CAGING GROUPS AND THEIR USE Max-Planck-Gesellschaft zur Förderung der Wissenschaften e.V. (DE) 2022-03-02 — — EP disclosed
EP-3898586-A1 HETEROCYCLIC AZIDE UNITS AND THEIR USE IN POLYMER COATINGS Illumina Cambridge Limited (GB) 2021-10-27 — — EP disclosed
US-20210284609-A1 HETEROCYCLIC AZIDE UNITS AND THEIR USE IN POLYMER COATINGS ILLUMINA CAMBRIDGE LIMITED (GB) 2021-09-16 — — US disclosed
CN-112672996-A Heterocyclic azide units and their use in polymeric coatings 伊鲁米纳剑桥有限公司 2021-04-16 — — CN disclosed
WO-2020126598-A1 HETEROCYCLIC AZIDE UNITS AND THEIR USE IN POLYMER COATINGS ILLUMINA CAMBRIDGE LIMITED (GB) 2020-06-25 — — WO 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-20240300896-A1 HETEROCYCLIC AZIDE UNITS AND THEIR USE IN POLYMER COATINGS POLL, PCNA, DNMT3A KDM4E 3663/4885ALDH1A1 2330/4885ADRA2A 4379/4885
US-20210284609-A1 HETEROCYCLIC AZIDE UNITS AND THEIR USE IN POLYMER COATINGS POLL, PCNA, DNMT3A KDM4E 3663/4885ALDH1A1 2330/4885ADRA2A 4379/4885
US-11999696-B2 Heterocyclic azide units and their use in polymer coatings POLL, PCNA, DNMT3A KDM4E 3663/4885ALDH1A1 2330/4885ADRA2A 4379/4885

“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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