SCHEMBL4883177

SCHEMBL4883177

N=C(N)NCCC[C@H](N)C(O)O

nearest known ligand 0.41

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.41
CYP1A2 P05177 1/20 0.41
KMT2A Q03164 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
ALOX15 P16050 1/20 0.38
TSHR P16473 1/20 0.32
HIF1A Q16665 1/20 0.32
ALB P02768 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
SCHEMBL17985760 0.88 MEN1 (0.41) MEN1CYP1A2KMT2ASMN1; SMN2ALOX15
SCHEMBL21011320 0.84 MEN1 (0.43) MEN1CYP1A2KMT2ASMN1; SMN2ALOX15
SCHEMBL22400069 0.84 MEN1 (0.43) MEN1CYP1A2KMT2ASMN1; SMN2ALOX15
SCHEMBL14367895 0.83 MEN1 (0.44) MEN1CYP1A2KMT2ASMN1; SMN2ALOX15
SCHEMBL28843387 0.82 MEN1 (0.38) MEN1CYP1A2KMT2ASMN1; SMN2ALOX15
SCHEMBL11531988 0.82 MEN1 (0.40) MEN1CYP1A2KMT2ASMN1; SMN2ALOX15
SCHEMBL12664131 0.82 MEN1 (0.40) MEN1CYP1A2KMT2ASMN1; SMN2ALOX15
SCHEMBL21774708 0.81 CYP1A2 (0.37) MEN1CYP1A2KMT2ASMN1; SMN2ALOX15
SCHEMBL19891843 0.81 MEN1 (0.37) MEN1CYP1A2KMT2ASMN1; SMN2ALOX15
SCHEMBL18868116 0.81 MEN1 (0.37) 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
EP-3797796-A1 ANTIBODY-DRUG CONJUGATE AND APPLICATION THEREOF Mabplex International, Ltd. (CN) 2021-03-31 EP disclosed
US-8404465-B2 Biological synthesis of 6-aminocaproic acid from carbohydrate feedstocks CELEXION, LLC (US) 2013-03-26 US disclosed
US-8404465-B2 Biological synthesis of 6-aminocaproic acid from carbohydrate feedstocks CELEXION, LLC (US) 2013-03-26 US disclosed
US-20080039531-A1 Compositions, and kits comprising targeted aldehyde or acetal protease inhibitor compounds for treating muscle disorders STRACHER ALFRED 2008-02-14 US disclosed
EP-1805207-A1 TREATMENT OF TRAUMATIC OR DEGENERATIVE NEUROLOGIC, OTOLOGIC, OR OPHTHALMOLOGIC DISEASES WITH TARGETED PROTEASE INHIBITORS Ceptor Corporation (US) 2007-07-11 EP disclosed
WO-2006037133-A1 TREATMENT OF TRAUMATIC OR DEGENERATIVE NEUROLOGIC, OTOLOGIC, OR OPHTHALMOLOGIC DISEASES WITH TARGETED PROTEASE INHIBITORS CEPTOR CORPORATION (US) 2006-04-06 WO 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-20080039531-A1 Compositions, and kits comprising targeted aldehyde or acetal protease inhibitor compounds for treating muscle disorders CPT1B, CAPNS1, CAPN1 MEN1 4472/4885CYP1A2 4395/4885KMT2A 1817/4885

“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.