SCHEMBL29322636

SCHEMBL29322636

C[N+](C)(C)CCC[N+](C)(C)CCCN1C(=O)c2ccc3c4c(ccc(c24)C1=O)C(=O)N(CCC[N+](C)(C)CC[N+](C)(C)C)C3=O

nearest known ligand 0.82

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ TERT O14746 3/20 0.82
▸ CYP3A4 P08684 1/20 0.59
▸ NFKB1 P19838 1/20 0.59
▸ HSD17B10 Q99714 1/20 0.59
▸ KMT2A Q03164 2/20 0.59
▸ CHRM2 P08172 2/20 0.59
▸ MEN1 O00255 1/20 0.59
▸ CYP1A2 P05177 1/20 0.59
▸ CYP2C19 P33261 1/20 0.59
▸ KDM4E B2RXH2 1/20 0.58
▸ ALDH1A1 P00352 1/20 0.58
▸ POLB P06746 1/20 0.58
▸ HPGD P15428 1/20 0.58
▸ HK1 P19367 1/20 0.58
▸ APEX1 P27695 1/20 0.58
▸ RECQL P46063 1/20 0.58
▸ BLM P54132 1/20 0.58
▸ SMN1; SMN2 Q16637 1/20 0.58
▸ HKDC1 Q2TB90 1/20 0.58

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
SCHEMBL26378291 0.91 TERT (1.00) TERTCYP3A4NFKB1HSD17B10KMT2A
SCHEMBL6234260 0.84 TERT (0.87) TERTCYP3A4NFKB1HSD17B10KMT2A
SCHEMBL34460906 0.84 TERT (0.87) TERTCYP3A4NFKB1HSD17B10KMT2A
Iodide SCHEMBL6230746 0.83 TERT (0.84) TERTCYP3A4NFKB1HSD17B10KMT2A
Iodide SCHEMBL6232922 0.82 TERT (0.82) TERTCYP3A4NFKB1HSD17B10KMT2A
SCHEMBL22506215 0.81 TERT (0.79) TERTCYP3A4NFKB1HSD17B10KMT2A
SCHEMBL34460911 0.77 TERT (0.73) TERTCYP3A4NFKB1HSD17B10KMT2A
SCHEMBL2196672 0.77 CHRM2 (0.75) TERTKMT2ACHRM2MEN1CYP1A2
Iodide SCHEMBL6234377 0.77 TERT (0.64) TERTCYP3A4NFKB1HSD17B10KMT2A
Iodide SCHEMBL6229670 0.76 CYP3A4 (0.60) TERTCYP3A4NFKB1HSD17B10KMT2A

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-20240243327-A1 NAPHTHALENE DIIMIDE COMPOUND AND REDOX FLOW BATTERY CONTAINING THE SAME KOREA ADVANCED INSTITUTE OF SCIENCE AND TECHNOLOGY (KR) 2024-07-18 — — 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-20240243327-A1 NAPHTHALENE DIIMIDE COMPOUND AND REDOX FLOW BATTERY CONTAINING THE SAME IDH2, NDUFV2, NDUFS8 TERT 382/4885CYP3A4 2004/4885NFKB1 1373/4885

“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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