SCHEMBL4861448

SCHEMBL4861448

Cc1cccc2nnc(NNC(=O)C3(CN(O)C=O)CCCCCC3)nc12

nearest known ligand 0.34

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
P2RX7 Q99572 2/20 0.34
SRC P12931 9/20 0.32
THRB P10828 1/20 0.31
YES1 P07947 1/20 0.31
PDGFRB P09619 1/20 0.31
EPHB4 P54760 1/20 0.31
RXFP1 Q9HBX9 1/20 0.30

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
SCHEMBL4869256 0.92 SRC (0.31) SRC
SCHEMBL4862460 0.90 SRC (0.31) SRC
SCHEMBL4868061 0.82 LMNA (0.30)
SCHEMBL1595343 0.78
SCHEMBL1595346 0.78
SCHEMBL4867298 0.76 KDM4E (0.34) P2RX7
SCHEMBL1595920 0.75 POLB (0.33) P2RX7YES1PDGFRBEPHB4RXFP1
SCHEMBL1595923 0.75 POLB (0.33) P2RX7YES1PDGFRBEPHB4RXFP1
SCHEMBL1595047 0.74 RXFP1 (0.33) P2RX7SRCYES1PDGFRBEPHB4
SCHEMBL1595043 0.74 RXFP1 (0.33) P2RX7SRCYES1PDGFRBEPHB4

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 5 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 claimed
US-20060160802-A1 Peptide deformylase inhibitors GLAXO GROUP LIMITED 2006-07-20 US claimed
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
WO-2005005456-A2 PEPTIDE DEFORMYLASE INHIBITORS GLAXO GROUP LIMITED (GB) 2005-01-20 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-20060160802-A1 Peptide deformylase inhibitors PDF, PEPD, DPEP1 P2RX7 3139/4885SRC 4533/4885THRB 2788/4885

“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.