SCHEMBL26349201

SCHEMBL26349201

[N-]=[N+]=NCCOCCOCCOCCN1C(=O)c2ccc(-c3ccc4c(c3)C(=O)N(CCOCCOCCOCCN=[N+]=[N-])C4=O)cc2C1=O

nearest known ligand 0.49

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 4/20 0.49
▸ ABCG2 Q9UNQ0 6/20 0.39
▸ MGMT P16455 1/20 0.39
▸ ALDH1A1 P00352 3/20 0.39
▸ CRBN Q96SW2 2/20 0.38
▸ ACLY P53396 1/20 0.38
▸ HPGD P15428 2/20 0.36
▸ NPSR1 Q6W5P4 1/20 0.36
▸ MEN1 O00255 1/20 0.35
▸ HTT P42858 1/20 0.35
▸ KMT2A Q03164 1/20 0.35
▸ MAPK1 P28482 2/20 0.35
▸ TSHR P16473 1/20 0.35
▸ L3MBTL1 Q9Y468 1/20 0.35
▸ MGLL Q99685 1/20 0.35
▸ GAA P10253 1/20 0.35
▸ HSD17B10 Q99714 1/20 0.35

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
SCHEMBL29199650 0.86 HPGD (0.49) MGMTALDH1A1HPGDNPSR1KMT2A
SCHEMBL26349189 0.86 MGMT (0.42) KDM4EMGMTALDH1A1HPGDNPSR1
SCHEMBL26349215 0.85 ALDH1A1 (0.38) KDM4EMGMTALDH1A1HPGDNPSR1
SCHEMBL26349218 0.85 ALDH1A1 (0.52) ALDH1A1HPGDMEN1KMT2ATSHR
SCHEMBL14499669 0.85 HPGD (0.50) ALDH1A1HPGDNPSR1KMT2AMAPK1
SCHEMBL26349212 0.82 MGMT (0.34) KDM4EABCG2MGMTALDH1A1HPGD
SCHEMBL26349204 0.81 ALDH1A1 (0.45) KDM4EABCG2MGMTALDH1A1HPGD
SCHEMBL25495612 0.76 MGMT (0.42) ABCG2MGMTMGLL
SCHEMBL30459062 0.75 CYP1B1 (0.53) KDM4EALDH1A1MEN1KMT2A
SCHEMBL15096386 0.75 CYP1B1 (0.53) KDM4EALDH1A1MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230303502-A1 HETEROARYL AND HETEROCYCLYL COMPOUNDS SIGILON THERAPEUTICS, INC. 2023-09-28 — — US disclosed
US-20230303502-A1 HETEROARYL AND HETEROCYCLYL COMPOUNDS SIGILON THERAPEUTICS, INC. 2023-09-28 — — 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-20230303502-A1 HETEROARYL AND HETEROCYCLYL COMPOUNDS CYP3A43, CYP2C9, CYP2C19 KDM4E 4396/4885ABCG2 4/4885MGMT 2441/4885

“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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