SCHEMBL5404918

SCHEMBL5404918

CCC(C(N)=O)=C(CC)C(=O)O

nearest known ligand 0.42

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
LDHA P00338 1/20 0.42
LDHB P07195 1/20 0.42
GRIK1 P39086 2/20 0.40
FFAR3 O14843 1/20 0.40
GRIA4 P48058 1/20 0.40
GRIK3 Q13003 1/20 0.40
GRIK5 Q16478 1/20 0.40
TDP1 Q9NUW8 3/20 0.33
ALDH1A1 P00352 1/20 0.33
THRB P10828 1/20 0.32
FNTA P49354 1/20 0.32
FNTB P49356 1/20 0.32
PGGT1B P53609 1/20 0.32
ALOX15 P16050 3/20 0.32
ACHE P22303 1/20 0.32
LMNA P02545 1/20 0.30
BLM P54132 1/20 0.30
PMP22 Q01453 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
SCHEMBL5404916 1.00 LDHA (0.42) LDHALDHBGRIK1FFAR3GRIA4
SCHEMBL1831176 0.88 TDP1 (0.41) LDHALDHBGRIK1FFAR3GRIA4
SCHEMBL1831174 0.88 TDP1 (0.41) LDHALDHBGRIK1FFAR3GRIA4
SCHEMBL8688580 0.88 TDP1 (0.41) LDHALDHBGRIK1FFAR3GRIA4
SCHEMBL101165 0.85 FFAR3 (0.53) GRIK1FFAR3GRIA4GRIK3GRIK5
SCHEMBL42601 0.85 FFAR3 (0.53) GRIK1FFAR3GRIA4GRIK3GRIK5
SCHEMBL42603 0.85 FFAR3 (0.53) GRIK1FFAR3GRIA4GRIK3GRIK5
Hydrochloric Acid SCHEMBL9622192 0.82 FFAR3 (0.50) GRIK1FFAR3GRIA4GRIK3GRIK5
SCHEMBL305428 0.82 FFAR3 (0.50) GRIK1FFAR3GRIA4GRIK3GRIK5
SCHEMBL304063 0.82 FFAR3 (0.50) GRIK1FFAR3GRIA4GRIK3GRIK5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7208314-B2 Compositions and methods for drug delivery using pH sensitive molecules MIRUS BIO CORPORATION (US) 2007-04-24 US disclosed
US-7138382-B2 Compositions and methods for drug delivery using pH sensitive molecules MIRUS BIO CORPORATION (US) 2006-11-21 US disclosed
US-7098032-B2 Compositions and methods for drug delivery using pH sensitive molecules MIRUS BIO CORPORATION (US) 2006-08-29 US disclosed
EP-1102785-A4 COMPOSITIONS AND METHODS FOR DRUG DELIVERY USING pH SENSITIVE MOLECULES MIRUS CORP (US) 2006-04-05 EP disclosed
US-6919091-B2 Compositions and methods for drug delivery using pH sensitive molecules MIRUS CORPORATION (US) 2005-07-19 US disclosed
US-20050123600-A1 Compositions and methods for drug delivery using pH sensitive molecules ROCHE MADISON INC. 2005-06-09 US disclosed
US-20040058446-A1 Compositions and methods for drug delivery using pH sensitive molecules Arrowhead Madison Inc. 2004-03-25 US disclosed
US-20030199090-A1 Compositions and methods for drug delivery using pH sensitive molecules Arrowhead Pharmaceuticals, Inc. 2003-10-23 US disclosed
US-6630351-B1 Transfecting a cell by attaching a reversible labile membrane activity inhibitor to a melittin peptide; adding peptide to solution containing the nucleic acid; endocytosis MIRUS CORPORATION 2003-10-07 US disclosed
US-20030026841-A1 Compositions and methods for drug delivery using pH sensitive molecules Arrowhead Madison Inc. 2003-02-06 US disclosed
EP-1102785-A1 COMPOSITIONS AND METHODS FOR DRUG DELIVERY USING pH SENSITIVE MOLECULES Mirus Corporation (US) 2001-05-30 EP disclosed
WO-2000075164-A1 COMPOSITIONS AND METHODS FOR DRUG DELIVERY USING pH SENSITIVE MOLECULES MIRUS CORPORATION (US) 2000-12-14 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 (3 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-20040058446-A1 Compositions and methods for drug delivery using pH sensitive molecules ABCC1, DNA2, ANXA6 LDHA 34/4885LDHB 50/4885GRIK1 3245/4885
US-20030026841-A1 Compositions and methods for drug delivery using pH sensitive molecules POLI, POLN, POLRMT LDHA 1265/4885LDHB 1438/4885GRIK1 3141/4885
US-20050123600-A1 Compositions and methods for drug delivery using pH sensitive molecules POLI, POLN, POLRMT LDHA 1265/4885LDHB 1438/4885GRIK1 3141/4885

“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.