Isophthalic Dicarboxaldehyde

Isophthalic Dicarboxaldehyde

SCHEMBL3111980

C=[N+]([O-])c1ccccc1.C=[N+]([O-])c1ccccc1.O=Cc1cccc(C=O)c1

nearest known ligand 0.47

Full drug profile on Sugi Atlas →

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ NFE2L2 Q16236 1/20 0.47
▸ ALDH1A1 P00352 5/20 0.46
▸ CYP2A6 P11509 1/20 0.46
▸ MEN1 O00255 2/20 0.44
▸ KMT2A Q03164 2/20 0.44
▸ UNG P13051 1/20 0.43
▸ MAPT P10636 3/20 0.41
▸ FBP1 P09467 5/20 0.40
▸ MAOB P27338 2/20 0.40
▸ NR1H4 Q96RI1 1/20 0.40
▸ MAOA P21397 1/20 0.40
▸ LMNA P02545 3/20 0.39
▸ VCP P55072 1/20 0.39
▸ CYP19A1 P11511 1/20 0.39
▸ NPC1 O15118 1/20 0.38
▸ RAB9A P51151 1/20 0.38
▸ TRIM24 O15164 1/20 0.38
▸ TRIM33 Q9UPN9 1/20 0.38
▸ TSHR P16473 1/20 0.38

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
SCHEMBL3116346 0.86 ALDH1A1 (0.52) NFE2L2ALDH1A1CYP2A6MEN1KMT2A
Isophthalic Dicarboxaldehyde SCHEMBL3104078 0.80 ALDH1A1 (0.48) NFE2L2ALDH1A1CYP2A6MEN1KMT2A
SCHEMBL10824676 0.77 — —
Isophthalic Dicarboxaldehyde SCHEMBL28611144 0.77 ALDH1A1 (0.67) ALDH1A1CYP2A6UNGFBP1MAOB
Dinitrophenylene SCHEMBL28140778 0.76 NFE2L2 (0.68) NFE2L2ALDH1A1CYP2A6MEN1KMT2A
3-Nitrobenzaldehyde SCHEMBL28242228 0.75 NFE2L2 (0.67) NFE2L2ALDH1A1MEN1KMT2AMAPT
Isophthalic Dicarboxaldehyde SCHEMBL20477528 0.75 ALDH1A1 (0.61) ALDH1A1CYP2A6UNGFBP1MAOB
3-Nitrobenzaldehyde SCHEMBL54487 0.75 NFE2L2 (0.67) NFE2L2ALDH1A1MEN1KMT2AMAPT
3-Nitrobenzaldehyde SCHEMBL29573715 0.75 NFE2L2 (0.67) NFE2L2ALDH1A1MEN1KMT2AMAPT
Isophthalic Dicarboxaldehyde SCHEMBL180566 0.74 ALDH1A1 (0.67) ALDH1A1CYP2A6UNGFBP1MAOB

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-20100273910-A1 POLYNITRONES AND USE THEREOF FOR CROSS-LINKING UNSATURATED POLYMERS HEINRICH-HEINE-UNIVERSITÄT (DE) 2010-10-28 — — US claimed
US-8883931-B2 Polynitrones and use thereof for cross-linking unsaturated polymers HEINRICH-HEINE-UNIVERSITAT (DE) 2014-11-11 — — US disclosed
US-20100273910-A1 POLYNITRONES AND USE THEREOF FOR CROSS-LINKING UNSATURATED POLYMERS HEINRICH-HEINE-UNIVERSITÄT (DE) 2010-10-28 — — 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-20100273910-A1 POLYNITRONES AND USE THEREOF FOR CROSS-LINKING UNSATURATED POLYMERS PNN, MNAT1, NCL NFE2L2 1853/4885ALDH1A1 859/4885CYP2A6 4334/4885

“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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