SCHEMBL2637671

SCHEMBL2637671

CCOC(=O)CC(CC(C)C)C(=O)O

nearest known ligand 0.48

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
SLC1A3 P43003 1/20 0.46
SLC1A2 P43004 1/20 0.46
MME P08473 4/20 0.45
CPA1 P15085 1/20 0.43
MGAM O43451 1/20 0.41
GAA P10253 1/20 0.41
SI P14410 1/20 0.41
MGAM2 Q2M2H8 1/20 0.41
LAP3 P28838 2/20 0.39
ALDH1A1 P00352 3/20 0.39
TRPA1 O75762 1/20 0.39
ANPEP P15144 1/20 0.39
RNPEP Q9H4A4 1/20 0.38
SLC7A5 Q01650 1/20 0.38
TSHR P16473 2/20 0.37
CYP3A4 P08684 1/20 0.37
ALOX15 P16050 1/20 0.37
TDP1 Q9NUW8 1/20 0.37
SLC15A1 P46059 1/20 0.36

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
SCHEMBL5558434 1.00 SLC1A3 (0.46) SLC1A3SLC1A2MMECPA1MGAM
SCHEMBL8047058 1.00 SLC1A3 (0.46) SLC1A3SLC1A2MMECPA1MGAM
SCHEMBL1246334 0.86 MGAM (0.43) MMECPA1MGAMGAASI
SCHEMBL6265890 0.86 MGAM (0.50) MGAMGAASIMGAM2ALDH1A1
SCHEMBL2637637 0.83 ALOX15 (0.40) SLC1A3SLC1A2MGAMGAASI
SCHEMBL8797367 0.82 NAAA (0.42) SLC1A3SLC1A2MMECPA1ALDH1A1
SCHEMBL1823767 0.82 MGAM (0.46) SLC1A3SLC1A2MGAMGAASI
SCHEMBL4755497 0.82 MGAM (0.46) SLC1A3SLC1A2MGAMGAASI
SCHEMBL7767241 0.80 MGAM (0.44) CPA1MGAMGAASIMGAM2
SCHEMBL4743296 0.80 MME (0.51) SLC1A3SLC1A2MMECPA1LAP3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9546228-B2 Modification of polymers containing an anhydride and uses thereof ISP INVESTMENTS LLC (US) 2017-01-17 US disclosed
US-20150315307-A1 MODIFICATION OF POLYMERS CONTAINING AN ANHYDRIDE AND USES THEREOF ISP INVESTMENTS INC. (US) 2015-11-05 US disclosed
WO-2011141923-A2 IMPROVED SYNTHESIS OF OPTICALLY PURE (S) - 3-CYANO-5-METHYL-HEXANOIC ACID ALKYL ESTER, AN INTERMEDIATE OF (S)- PREGABALIN LUPIN LIMITED (IN) 2011-11-17 WO disclosed
WO-2011141923-A2 IMPROVED SYNTHESIS OF OPTICALLY PURE (S) - 3-CYANO-5-METHYL-HEXANOIC ACID ALKYL ESTER, AN INTERMEDIATE OF (S)- PREGABALIN LUPIN LIMITED (IN) 2011-11-17 WO disclosed
US-20070197577-A1 Inhibitors of anthrax lethal factor CENGENT THERAPEUTICS (US) 2007-08-23 US disclosed
WO-2005027856-A2 INHIBITORS OF ANTHRAX LETHAL FACTOR CENGENT THERAPEUTICS (US) 2005-03-31 WO disclosed
EP-0214639-B1 HYDROXAMIC ACID BASED COLLAGENASE INHIBITORS G.D. Searle & Co. (US) 1990-06-13 EP disclosed
US-4743587-A ANTIARTHRITIC AGENTS G. D. SEARLE & CO. (US) 1988-05-10 US disclosed
EP-0214639-A2 Hydroxamic acid based collagenase inhibitors G.D. Searle & Co. (US) 1987-03-18 EP disclosed
US-4599361-A ANTIARTHRITIC G. D. SEARLE & CO. (US) 1986-07-08 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-20070197577-A1 Inhibitors of anthrax lethal factor APAF1, ANTXR2, LITAF SLC1A3 4701/4885SLC1A2 4790/4885MME 462/4885

“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.