SCHEMBL4870558

SCHEMBL4870558

CC1CCC(C(C(=O)NNc2nc(-c3ccccn3)cc(C3CC3)n2)N(O)C=O)CC1

nearest known ligand 0.34

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.34
CYP2D6 P10635 1/20 0.34
MCHR1 Q99705 1/20 0.33
GPR39 O43194 4/20 0.33
RAB9A P51151 3/20 0.33
MAPT P10636 3/20 0.33
ALDH1A1 P00352 2/20 0.33
HPGD P15428 2/20 0.33
PDE10A Q9Y233 4/20 0.33
NPC1 O15118 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
CYP3A4 P08684 3/20 0.32
CYP2C9 P11712 1/20 0.32
KMT2A Q03164 1/20 0.32
KDM4E B2RXH2 1/20 0.32
POLB P06746 1/20 0.32
NR4A1 P22736 1/20 0.32
HTT P42858 1/20 0.32

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
SCHEMBL4867247 0.87 SYK (0.38) RAB9AMAPTALDH1A1HPGD
SCHEMBL4870519 0.77 GPR39 (0.34) LMNACYP2D6GPR39MAPTPDE10A
SCHEMBL4870529 0.77 GPR39 (0.34) LMNACYP2D6GPR39MAPTPDE10A
SCHEMBL4866392 0.77 POLB (0.36) LMNARAB9AALDH1A1NPC1SMN1; SMN2
SCHEMBL4862605 0.75 ABL1 (0.42)
SCHEMBL4864629 0.73 GAA (0.41) MAPT
SCHEMBL4872993 0.72 SYK (0.36) CYP2D6RAB9AMAPTHPGDNPC1
SCHEMBL4870902 0.70
SCHEMBL4862478 0.70 SRC (0.33)
SCHEMBL4872772 0.70

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 LMNA 2515/4885CYP2D6 4185/4885MCHR1 4124/4885

“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.