SCHEMBL4239694

SCHEMBL4239694

C[C@@H](NC(=O)O)C(=O)N1CCCC1

nearest known ligand 0.54

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
HPGD P15428 1/20 0.41
MMP1 P03956 1/20 0.39
MMP2 P08253 1/20 0.39
MMP8 P22894 1/20 0.39
JAK2 O60674 2/20 0.38
JAK1 P23458 2/20 0.38
JAK3 P52333 2/20 0.38
FPR3 P25089 1/20 0.38
FPR2 P25090 1/20 0.38
EGFR P00533 1/20 0.38
ALDH1A1 P00352 1/20 0.37
HTT P42858 1/20 0.37
PKM P14618 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
ITGB3 P05106 1/20 0.36
ITGA2B P08514 1/20 0.36
PREP P48147 1/20 0.36
FAP Q12884 1/20 0.36

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
SCHEMBL17275494 1.00 HPGD (0.41) HPGDMMP1MMP2MMP8JAK2
SCHEMBL5552024 0.98 MMP1 (0.41) HPGDMMP1MMP2MMP8JAK2
SCHEMBL22979668 0.84 HSD17B10 (0.45) ALDH1A1
SCHEMBL22979670 0.84 HSD17B10 (0.45) ALDH1A1
SCHEMBL17282576 0.83 PREP (0.50) HPGDMMP1MMP2MMP8JAK2
SCHEMBL27154468 0.82 CHRM5 (0.42) HPGDITGB3ITGA2B
SCHEMBL9050303 0.82 SMN1; SMN2 (0.53) ALDH1A1HTTPKMSMN1; SMN2
SCHEMBL27154469 0.82 CHRM5 (0.42) HPGDITGB3ITGA2B
SCHEMBL8525273 0.82 PKM (0.46) HPGDMMP1MMP2MMP8JAK2
SCHEMBL17991731 0.82 PREP (0.49) MMP1MMP2MMP8JAK2JAK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090306066-A1 PEPTIDE DEFORMYLASE INHIBITORS GLAXOSMITHKLINE LLC 2009-12-10 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-20090306066-A1 PEPTIDE DEFORMYLASE INHIBITORS PDF, DHPS, PADI3 HPGD 1121/4885MMP1 1304/4885MMP2 884/4885

“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.