SCHEMBL22327063

SCHEMBL22327063

CNCCNC(=O)c1cccc(OCC(C)(N)OCCOCC(=O)NCC#CC(C)C)c1

nearest known ligand 0.39

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 4/20 0.36
▸ KMT2A Q03164 2/20 0.36
▸ HTT P42858 1/20 0.36
▸ SMN1; SMN2 Q16637 2/20 0.35
▸ F10 P00742 2/20 0.35
▸ MAOB P27338 2/20 0.35
▸ GAA P10253 1/20 0.35
▸ MAPT P10636 1/20 0.35
▸ GHSR Q92847 1/20 0.34
▸ KDM4E B2RXH2 1/20 0.34
▸ NSD2 O96028 1/20 0.34
▸ DRD2 P14416 2/20 0.34
▸ DRD4 P21917 2/20 0.34
▸ DRD3 P35462 2/20 0.34
▸ PRMT5 O14744 1/20 0.34
▸ WDR77 Q9BQA1 1/20 0.34
▸ GPR139 Q6DWJ6 1/20 0.33

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
SCHEMBL22327316 0.93 GAA (0.40) ALDH1A1KMT2AHTTSMN1; SMN2F10
SCHEMBL26068676 0.93 MAOB (0.36) ALDH1A1KMT2AHTTSMN1; SMN2F10
SCHEMBL22598488 0.88 ALDH1A1 (0.35) ALDH1A1KMT2AHTTSMN1; SMN2MAOB
SCHEMBL22327218 0.88 ALDH1A1 (0.35) ALDH1A1KMT2AHTTSMN1; SMN2MAOB
SCHEMBL22598389 0.88 ALDH1A1 (0.35) ALDH1A1KMT2AHTTSMN1; SMN2MAOB
SCHEMBL22327213 0.88 ALDH1A1 (0.35) ALDH1A1KMT2AHTTSMN1; SMN2MAOB
SCHEMBL22598408 0.88 ALDH1A1 (0.35) ALDH1A1KMT2AHTTSMN1; SMN2MAOB
SCHEMBL22327071 0.88 ALDH1A1 (0.35) ALDH1A1KMT2AHTTSMN1; SMN2MAOB
SCHEMBL22598364 0.88 ALDH1A1 (0.35) ALDH1A1KMT2AHTTSMN1; SMN2MAOB
SCHEMBL22327242 0.88 ALDH1A1 (0.35) ALDH1A1KMT2AHTTSMN1; SMN2MAOB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230203083-A1 NUCLEOTIDE ANALOGUES FIRST-CITIZENS BANK & TRUST COMPANY 2023-06-29 — — US disclosed
US-20230028359-A1 NUCLEOTIDE ANALOGUES FIRST-CITIZENS BANK & TRUST COMPANY 2023-01-26 — — US disclosed
US-20230002436-A1 MODIFIED NUCLEOTIDES AND USES THEREOF FIRST-CITIZENS BANK & TRUST COMPANY 2023-01-05 — — US disclosed
US-11174281-B1 Modified nucleotides and uses thereof Singular Genomics Systems, Inc. (US) 2021-11-16 — — US disclosed
US-10738072-B1 Nucleotide analogues Singular Genomics Systems, Inc. (US) 2020-08-11 — — 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 (5 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-20230002436-A1 MODIFIED NUCLEOTIDES AND USES THEREOF NUDT1, RNMT, ADAR ALDH1A1 1149/4885KMT2A 1548/4885HTT 1240/4885
US-11174281-B1 Modified nucleotides and uses thereof NUDT1, RNMT, ADAR ALDH1A1 1149/4885KMT2A 1548/4885HTT 1240/4885
US-20230028359-A1 NUCLEOTIDE ANALOGUES ITPA, POLB, NUDT1 ALDH1A1 1313/4885KMT2A 1334/4885HTT 1263/4885
US-10738072-B1 Nucleotide analogues NUDT1, POLN, TYMP ALDH1A1 1629/4885KMT2A 2130/4885HTT 1171/4885
US-20230203083-A1 NUCLEOTIDE ANALOGUES ITPA, POLB, NUDT1 ALDH1A1 1313/4885KMT2A 1334/4885HTT 1263/4885

“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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