SCHEMBL4868042

SCHEMBL4868042

CCCCC1CC(C(=O)O)(C(=O)OC)C1

nearest known ligand 0.38

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.36
NAAA Q02083 1/20 0.35
CYP1A2 P05177 1/20 0.33
TLR4 O00206 1/20 0.33
HTT P42858 1/20 0.32
TP53 P04637 1/20 0.31
POLB P06746 1/20 0.31
HPGD P15428 1/20 0.31
ALDH1A1 P00352 2/20 0.31
GAA P10253 2/20 0.31
EPHX2 P34913 1/20 0.31
USP2 O75604 1/20 0.31
DNTT P04053 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
SCHEMBL4868026 0.91 NAAA (0.37) MAPTNAAACYP1A2TLR4HTT
SCHEMBL23533404 0.80 ALOX5 (0.42) MAPTCYP1A2HTTTP53ALDH1A1
SCHEMBL8774500 0.79 ALOX5 (0.44) TP53ALDH1A1
SCHEMBL4867339 0.75 NAAA (0.34) MAPTNAAACYP1A2TLR4POLB
SCHEMBL4868091 0.74 CYP3A4 (0.41) CYP1A2ALDH1A1
SCHEMBL11343623 0.74 FYN (0.36) MAPTALDH1A1
SCHEMBL14035534 0.73 MAPT (0.34) MAPTHTTALDH1A1GAAEPHX2
SCHEMBL28319003 0.72 CYP1A2 (0.47) MAPTNAAACYP1A2TLR4HTT
SCHEMBL8774101 0.72 MAPT (0.39) MAPTCYP1A2TLR4HTTTP53
SCHEMBL23533298 0.71 ALDH1A1 (0.40) CYP1A2HTTTP53POLBHPGD

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 3 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
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 MAPT 3716/4885NAAA 935/4885CYP1A2 4681/4885

“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.