SCHEMBL6736374

SCHEMBL6736374

CCOC(=O)C1CC(C(=O)OCC)C1

nearest known ligand 0.54

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.50
MEN1 O00255 1/20 0.50
KMT2A Q03164 1/20 0.50
ALDH1A1 P00352 7/20 0.47
CYP3A4 P08684 1/20 0.46
CYP2D6 P10635 1/20 0.46
CYP2C9 P11712 1/20 0.46
CYP2C19 P33261 1/20 0.46
LMNA P02545 1/20 0.43
HSD17B10 Q99714 1/20 0.43
PPM1B O75688 1/20 0.42
PTPN1 P18031 1/20 0.42
PPP1CC P36873 1/20 0.42

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
SCHEMBL1298246 1.00 MAPT (0.50) MAPTMEN1KMT2AALDH1A1CYP3A4
SCHEMBL1297532 0.91 PPM1B (0.46) MAPTMEN1KMT2AALDH1A1CYP3A4
SCHEMBL1196597 0.91 MEN1 (0.45) MAPTMEN1KMT2AALDH1A1CYP3A4
SCHEMBL16175867 0.91 GAA (0.50) MAPTMEN1KMT2AALDH1A1CYP3A4
SCHEMBL28708961 0.91 PPM1B (0.46) MAPTMEN1KMT2AALDH1A1CYP3A4
SCHEMBL28475951 0.91 PPM1B (0.46) MAPTMEN1KMT2AALDH1A1CYP3A4
SCHEMBL1169394 0.90 MAPT (0.52) MAPTMEN1KMT2AALDH1A1CYP3A4
SCHEMBL17722440 0.88 MEN1 (0.46) MAPTMEN1KMT2AALDH1A1CYP3A4
SCHEMBL14898977 0.88 MEN1 (0.46) MAPTMEN1KMT2AALDH1A1CYP3A4
SCHEMBL16708922 0.88 MEN1 (0.46) MAPTMEN1KMT2AALDH1A1CYP3A4

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 8 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20130081999-A1 Bridged Macrocyclic Module Compositions WHITEFORD JEFFERY A (US) 2013-04-04 US disclosed
US-8182695-B2 Bridged macrocyclic module compositions WHITEFORD JEFFERY A (US) 2012-05-22 US disclosed
US-8110679-B2 Nanofilm and membrane compositions COVALENT PARTNERS LLC (US) 2012-02-07 US disclosed
US-7595368-B2 Nanofilm compositions with polymeric components COVALENT PARTNERS, LLC (US) 2009-09-29 US disclosed
US-20090114596-A1 NANOFILM AND MEMBRANE COMPOSITIONS COVALENT PARTNERS LLC 2009-05-07 US disclosed
US-20080290034-A1 Bridged macrocyclic module compositions COVALENT PARTNERS LLC 2008-11-27 US disclosed
US-7432371-B2 Nanofilm and membrane compositions COVALENT PARTNERS, LLC (US) 2008-10-07 US disclosed
US-7368564-B2 Bridged macrocyclic module compositions COVALENT PARTNERS, LLC (US) 2008-05-06 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 (2 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-20130081999-A1 Bridged Macrocyclic Module Compositions SBDS, NCL, INTS6 MAPT 2666/4885MEN1 1259/4885KMT2A 3432/4885
US-20080290034-A1 Bridged macrocyclic module compositions SBDS, NCL, INTS6 MAPT 2515/4885MEN1 1223/4885KMT2A 3294/4885

“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.