SCHEMBL10119913

SCHEMBL10119913

O=C(O)[C@@H]1C2C=CC(C2)[C@@H]1C(=O)OCc1ccccc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
FABP7 O15540 4/20 0.60
FABP5 Q01469 4/20 0.60
CA1 P00915 2/20 0.59
CA2 P00918 2/20 0.59
ALDH1A1 P00352 2/20 0.56
SMN1; SMN2 Q16637 2/20 0.56
POLB P06746 1/20 0.56
NPSR1 Q6W5P4 1/20 0.55
TAAR1 Q96RJ0 1/20 0.55
TDP1 Q9NUW8 1/20 0.50
LMNA P02545 1/20 0.49

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
SCHEMBL5837028 1.00 FABP7 (0.60) FABP7FABP5CA1CA2ALDH1A1
SCHEMBL5837030 1.00 FABP7 (0.60) FABP7FABP5CA1CA2ALDH1A1
SCHEMBL13197296 0.95 CA1 (0.62) FABP7FABP5CA1CA2ALDH1A1
SCHEMBL3285130 0.95 CA1 (0.62) FABP7FABP5CA1CA2ALDH1A1
SCHEMBL13197284 0.95 CA1 (0.62) FABP7FABP5CA1CA2ALDH1A1
SCHEMBL19323426 0.88 CA1 (0.63) FABP7FABP5CA1CA2ALDH1A1
SCHEMBL24515759 0.85 CA1 (0.54) FABP7FABP5CA1CA2ALDH1A1
SCHEMBL25641874 0.85 CA1 (0.54) FABP7FABP5CA1CA2ALDH1A1
SCHEMBL24515756 0.85 CA1 (0.54) FABP7FABP5CA1CA2ALDH1A1
SCHEMBL6737713 0.85 FABP7 (0.62) FABP7FABP5CA1CA2ALDH1A1

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-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 FABP7 4149/4885FABP5 3342/4885CA1 3361/4885

“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.