SCHEMBL8495474

SCHEMBL8495474

CCCCOC(=O)CNCc1ccccc1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LTA4H P09960 4/20 0.55
TSHR P16473 2/20 0.51
TDP1 Q9NUW8 2/20 0.51
L3MBTL1 Q9Y468 2/20 0.51
PPID Q08752 1/20 0.51
ALDH1A1 P00352 1/20 0.51
CYP3A4 P08684 1/20 0.51
MAPK1 P28482 1/20 0.51
KDM4E B2RXH2 3/20 0.50
LMNA P02545 2/20 0.50
SMN1; SMN2 Q16637 1/20 0.49
MITF O75030 1/20 0.47
GAA P10253 1/20 0.47
MEN1 O00255 2/20 0.47
KMT2A Q03164 2/20 0.47
EPHX2 P34913 1/20 0.47
NPC1 O15118 1/20 0.46
RAB9A P51151 1/20 0.46
RECQL P46063 1/20 0.46
P4HB P07237 1/20 0.45

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
SCHEMBL17449944 0.87 KDM4E (0.49) LTA4HTSHRL3MBTL1ALDH1A1KDM4E
SCHEMBL7366200 0.85 KDM4E (0.53) LTA4HKDM4EMEN1KMT2A
SCHEMBL12770916 0.85 LTA4H (0.58) LTA4HTSHRTDP1L3MBTL1ALDH1A1
SCHEMBL27575333 0.85 MEP1B (0.56) LTA4HTSHRSMN1; SMN2KMT2A
SCHEMBL75205 0.84 PPID (0.69) LTA4HPPIDALDH1A1SMN1; SMN2RECQL
SCHEMBL17241222 0.83 LTA4H (0.60) LTA4HALDH1A1MAPK1KDM4ELMNA
Hydrochloric Acid SCHEMBL3926946 0.83 PPID (0.68) LTA4HPPIDALDH1A1KDM4ESMN1; SMN2
SCHEMBL7366849 0.83 EPHX2 (0.56) ALDH1A1KDM4ESMN1; SMN2MEN1KMT2A
SCHEMBL30909992 0.82 SCN8A (0.51) LTA4H
SCHEMBL14793900 0.81 PLA2G2A (0.46) LTA4HTSHRPOLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11859018-B2 Peptoid-based chelating ligands for selective metal chelation TRIAD NATIONAL SECURITY, LLC (US) 2024-01-02 US disclosed
US-20220135623-A1 PEPTOID-BASED CHELATING LIGANDS FOR SELECTIVE METAL CHELATION U.S. DEPARTMENT OF ENERGY 2022-05-05 US disclosed
US-11254708-B2 Peptoid-based chelating ligands for selective metal chelation TRIAD NATIONAL SECURITY, LLC (US) 2022-02-22 US disclosed
US-5861380-A OXADIAZOLE, THIADIAZOLE AND TRIAZOLE PEPTOIDS AS INHIBITORS OF HUMAN NEUTROPHIL ELASTASE; ADULT RESPIRATORY DISTRESS SYNDROME; ANTIARTHRITIC,-INFLAMMATORY,-ISCHEMIC,-TUMOR AND -CARCINOGENIC AGENTS AND OTHER HNE-MEDIATED CONDITIONS CORTECH, INC. (US) 1999-01-19 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 (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-20220135623-A1 PEPTOID-BASED CHELATING LIGANDS FOR SELECTIVE METAL CHELATION SLC39A14, SLC39A11, SLC40A1 LTA4H 2215/4885TSHR 660/4885TDP1 2722/4885
US-11254708-B2 Peptoid-based chelating ligands for selective metal chelation SLC39A14, SLC39A11, SLC40A1 LTA4H 2215/4885TSHR 660/4885TDP1 2722/4885
US-11859018-B2 Peptoid-based chelating ligands for selective metal chelation SLC39A14, SLC39A11, SLC40A1 LTA4H 2215/4885TSHR 660/4885TDP1 2722/4885

“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.