SCHEMBL10119909

SCHEMBL10119909

COC(=O)[C@@H]1C2CC(C[C@@H]2NC(=O)OC(C)(C)C)[C@@H]1C(=O)OCc1ccccc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CPB1 P15086 2/20 0.48
CTSL P07711 1/20 0.43
KMT2A Q03164 2/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
PDE4B Q07343 1/20 0.42
SYK P43405 1/20 0.41
CYP2C9 P11712 3/20 0.41
CYP2C19 P33261 3/20 0.41
ALDH1A1 P00352 3/20 0.41
CYP1A2 P05177 2/20 0.41
MEN1 O00255 1/20 0.41
CYP3A4 P08684 2/20 0.41
TSHR P16473 2/20 0.41
POLB P06746 1/20 0.41
CYP2D6 P10635 1/20 0.41
KDM1A O60341 2/20 0.40
MAOB P27338 1/20 0.40
FABP7 O15540 1/20 0.39
FABP5 Q01469 1/20 0.39
LMNA P02545 1/20 0.38

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
SCHEMBL13198694 1.00 CPB1 (0.48) CPB1CTSLKMT2AL3MBTL1PDE4B
SCHEMBL10119906 1.00 CPB1 (0.48) CPB1CTSLKMT2AL3MBTL1PDE4B
SCHEMBL13198690 0.93 FABP7 (0.44) CPB1CTSLKMT2AL3MBTL1PDE4B
SCHEMBL10119907 0.93 FABP7 (0.44) CPB1CTSLKMT2AL3MBTL1PDE4B
SCHEMBL10119904 0.90 CPB1 (0.43) CPB1CTSLKMT2AL3MBTL1PDE4B
SCHEMBL13198696 0.90 CPB1 (0.43) CPB1CTSLKMT2AL3MBTL1PDE4B
SCHEMBL22617362 0.81 CPB1 (0.54) CPB1CTSLKMT2AL3MBTL1PDE4B
SCHEMBL14827594 0.81 ALDH1A1 (0.48) CPB1KMT2ACYP2C9CYP2C19ALDH1A1
SCHEMBL14827592 0.81 ALDH1A1 (0.48) CPB1KMT2ACYP2C9CYP2C19ALDH1A1
SCHEMBL6736876 0.81 BTK (0.42) KMT2AL3MBTL1CYP2C9KDM1AMAOB

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 7 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-8110679-B2 Nanofilm and membrane compositions COVALENT PARTNERS LLC (US) 2012-02-07 US disclosed
US-7767810-B2 Macrocyclic modules comprising linked cyclic synthon units for use in the formation of selectively permeable membranes COVALENT PARTNERS, LLC (US) 2010-08-03 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-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 (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-20130081999-A1 Bridged Macrocyclic Module Compositions SBDS, NCL, INTS6 CPB1 1531/4885CTSL 1353/4885KMT2A 3432/4885

“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.