SCHEMBL4870636

SCHEMBL4870636

CCC1CCC(C(=O)O)(C(=O)OC)CC1

nearest known ligand 0.34

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.33
MEN1 O00255 1/20 0.33
NPC1 O15118 1/20 0.33
RAB9A P51151 1/20 0.33
KMT2A Q03164 1/20 0.33
POLB P06746 1/20 0.32
LMNA P02545 1/20 0.32
KDM4E B2RXH2 1/20 0.32
ALDH1A1 P00352 1/20 0.32
GAA P10253 1/20 0.32
HPGD P15428 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32
CYP19A1 P11511 1/20 0.31
CYP4F2 P78329 1/20 0.30
CYP4A11 Q02928 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
SCHEMBL4870627 0.91 NPSR1 (0.34) MAPTMEN1NPC1RAB9AKMT2A
SCHEMBL29066690 0.86 CYP4F2 (0.33) MAPTLMNANPSR1CYP4F2CYP4A11
SCHEMBL28948901 0.84 OPRM1 (0.35) MAPTMEN1KMT2APOLBLMNA
Hydrochloric Acid SCHEMBL27278190 0.83 OPRM1 (0.35) MAPTMEN1KMT2APOLBLMNA
SCHEMBL4006703 0.79 NPSR1 (0.34) MAPTPOLBLMNANPSR1
SCHEMBL71320 0.78 NPSR1 (0.41) MAPTMEN1KMT2ALMNAALDH1A1
SCHEMBL14380147 0.78 FFAR3 (0.33) MAPTMEN1NPC1RAB9AKMT2A
SCHEMBL4797285 0.78 TLR4 (0.39) MAPTKMT2ALMNAALDH1A1
SCHEMBL1808841 0.76 POLB (0.33) MAPTMEN1NPC1RAB9AKMT2A
SCHEMBL1808842 0.76 POLB (0.33) MAPTMEN1NPC1RAB9AKMT2A

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 3716/4885MEN1 2495/4885NPC1 1328/4885

“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.