SCHEMBL31369896

SCHEMBL31369896

NC(=O)CCCC(=O)NC[C@H](N)C(=O)O

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX15 P16050 1/20 0.50
BLM P54132 1/20 0.50
PMP22 Q01453 1/20 0.50
KMT2A Q03164 1/20 0.50
GFPT1 Q06210 1/20 0.41
SLC1A2 P43004 2/20 0.40
SLC1A1 P43005 2/20 0.40
ITGB3 P05106 1/20 0.39
ITGA2B P08514 1/20 0.39
MMP2 P08253 1/20 0.38
NOD1 Q9Y239 1/20 0.38
GRM8 O00222 1/20 0.38
GRM6 O15303 1/20 0.38
GRIN2D O15399 1/20 0.38
GRIN3B O60391 1/20 0.38
GSR P00390 1/20 0.38
CYP1A2 P05177 1/20 0.38
GRIK1 P39086 1/20 0.38
GRM5 P41594 1/20 0.38
GRIA1 P42261 1/20 0.38

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
SCHEMBL25408583 0.89 SLC1A2 (0.47) GFPT1SLC1A2SLC1A1GRM8GRM6
SCHEMBL25408586 0.89 SLC1A2 (0.47) GFPT1SLC1A2SLC1A1GRM8GRM6
SCHEMBL1769037 0.85 GSR (0.48) ALOX15BLMPMP22KMT2AGFPT1
SCHEMBL1769038 0.85 GSR (0.48) ALOX15BLMPMP22KMT2AGFPT1
SCHEMBL8237369 0.83 NOD1 (0.49) GFPT1SLC1A2SLC1A1NOD1GRIK1
SCHEMBL16860714 0.83 NOD1 (0.49) GFPT1SLC1A2SLC1A1NOD1GRIK1
SCHEMBL1768772 0.83 MMP2 (0.54) ALOX15BLMKMT2AGFPT1SLC1A2
SCHEMBL1768771 0.83 MMP2 (0.54) ALOX15BLMKMT2AGFPT1SLC1A2
SCHEMBL16860735 0.81 NOD1 (0.55) KMT2ASLC1A2SLC1A1NOD1GRIK1
SCHEMBL29215257 0.81 NOD1 (0.55) KMT2ASLC1A2SLC1A1NOD1GRIK1

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-20240400499-A1 NOVEL AMINO ACID DERIVATIVES PEPTIDREAM INC (JP) 2024-12-05 US claimed
US-20240400499-A1 NOVEL AMINO ACID DERIVATIVES PEPTIDREAM INC (JP) 2024-12-05 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-20240400499-A1 NOVEL AMINO ACID DERIVATIVES BCAT1, BCAT2, PELP1 ALOX15 4849/4885BLM 4431/4885PMP22 3288/4885

“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.