SCHEMBL4870529

SCHEMBL4870529

C[C@H]1CC[C@](CN(O)C=O)(C(=O)NNc2nc(-c3ccccn3)cc(C3CC3)n2)CC1

nearest known ligand 0.36

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
GPR39 O43194 10/20 0.34
LMNA P02545 1/20 0.33
CYP2D6 P10635 1/20 0.33
KMT2A Q03164 1/20 0.32
HTT P42858 1/20 0.32
MAPT P10636 1/20 0.31
JAK1 P23458 1/20 0.31
SYK P43405 3/20 0.31
PDE10A Q9Y233 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
SCHEMBL4867228 0.88 SYK (0.38) SYK
SCHEMBL4867214 0.88 SYK (0.38) SYK
SCHEMBL4870558 0.77 LMNA (0.34) GPR39LMNACYP2D6KMT2AHTT
SCHEMBL4866379 0.77 POLB (0.35) KMT2ASYK
SCHEMBL4868106 0.75 VCP (0.33)
SCHEMBL4864613 0.74 GAA (0.38) SYK
SCHEMBL4864643 0.73
SCHEMBL4872963 0.72 SYK (0.37) CYP2D6KMT2AMAPTSYK
SCHEMBL4870712 0.71 KDM4E (0.31) HTT
SCHEMBL4870364 0.68 POLB (0.34) KMT2ASYK

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-7332485-B2 Peptide deformylase inhibitors SMITHKLINE BEECHAM CORP (US) 2008-02-19 US disclosed
US-20060160802-A1 Peptide deformylase inhibitors GLAXO GROUP LIMITED 2006-07-20 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-20060160802-A1 Peptide deformylase inhibitors PDF, PEPD, DPEP1 GPR39 3937/4885LMNA 2515/4885CYP2D6 4185/4885

“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.