SCHEMBL5147807

SCHEMBL5147807

N=C(N)NCCCC(N)N

nearest known ligand 0.45

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.45
CYP1A2 P05177 1/20 0.45
KMT2A Q03164 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
ALOX15 P16050 1/20 0.41
TSHR P16473 1/20 0.34
HIF1A Q16665 1/20 0.34
NPY4R P50391 3/20 0.31
NPY1R P25929 2/20 0.31
NPY2R P49146 2/20 0.31
NPY5R Q15761 2/20 0.31
OTC P00480 1/20 0.31
DPP7 Q9UHL4 1/20 0.31

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
SCHEMBL14367895 0.84 MEN1 (0.44) MEN1CYP1A2KMT2ASMN1; SMN2ALOX15
SCHEMBL20764127 0.82 MEN1 (0.42) MEN1CYP1A2KMT2ASMN1; SMN2ALOX15
SCHEMBL20969045 0.82 MEN1 (0.42) MEN1CYP1A2KMT2ASMN1; SMN2ALOX15
SCHEMBL463757 0.82 MEN1 (0.42) MEN1CYP1A2KMT2ASMN1; SMN2ALOX15
SCHEMBL13865707 0.82 MEN1 (0.42) MEN1CYP1A2KMT2ASMN1; SMN2ALOX15
SCHEMBL20406274 0.81 MEN1 (0.45) MEN1CYP1A2KMT2ASMN1; SMN2ALOX15
SCHEMBL17985760 0.80 MEN1 (0.41) MEN1CYP1A2KMT2ASMN1; SMN2ALOX15
SCHEMBL20822004 0.80 MEN1 (0.41) MEN1CYP1A2KMT2ASMN1; SMN2ALOX15
SCHEMBL4883177 0.80 MEN1 (0.41) MEN1CYP1A2KMT2ASMN1; SMN2ALOX15
SCHEMBL6545309 0.80 MEN1 (0.41) MEN1CYP1A2KMT2ASMN1; SMN2ALOX15

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2024081363-A1 COMPOSITION COMPRISING A FIRST RAS INHIBITOR, SECOND RAS INHIBITOR AND A SHP2 INHIBITOR FOR USE IN THE TREATMENT OF CANCER Revolution Medicines, Inc. (US) 2024-04-18 WO disclosed
EP-1615946-B1 PROTEOLYTIC AND COVALENT ANTIBODIES PAUL SUDHIR (US) 2020-05-06 EP disclosed
US-9006388-B2 Covalent attachment of ligands to nucleophilic proteins guided by non-covalent Paul, Sudhir (US) 2015-04-14 US disclosed
US-8980646-B2 Proteolytic and covalent antibodies PAUL, SUDHIR (US) 2015-03-17 US disclosed
US-20070179083-A1 Covalent attachment of ligands to nucleophilic proteins guided by non-covalent binding COVALENT BIOSCIENCE INCORPORATED 2007-08-02 US disclosed
US-20070105092-A1 Proteolytic and covalent antibodies COVALENT BIOSCIENCE INCORPORATED 2007-05-10 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-20070179083-A1 Covalent attachment of ligands to nucleophilic proteins guided by non-covalent binding FABP1, FPR1, ADGRF1 MEN1 4768/4885CYP1A2 2713/4885KMT2A 3133/4885

“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.