SCHEMBL3034500

SCHEMBL3034500

CCCCCC(CC)/C(=C\C(=O)O)C(=O)O

nearest known ligand 0.50

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CA2 P00918 7/20 0.50
MAPK1 P28482 1/20 0.50
CA1 P00915 4/20 0.44
GRIK1 P39086 2/20 0.42
GRIK2 Q13002 2/20 0.42
SLC1A2 P43004 1/20 0.42
SLC1A1 P43005 1/20 0.42
GPR84 Q9NQS5 6/20 0.40
FFAR1 O14842 1/20 0.40
MAPT P10636 1/20 0.39
LCK P06239 1/20 0.39
PPARD Q03181 1/20 0.39
ZDHHC20 Q5W0Z9 1/20 0.39
ZDHHC2 Q9UIJ5 1/20 0.39

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
SCHEMBL3039825 1.00 CA2 (0.50) CA2MAPK1CA1GRIK1GRIK2
SCHEMBL3034502 1.00 CA2 (0.50) CA2MAPK1CA1GRIK1GRIK2
Maleic Acid SCHEMBL7764433 0.95 CA2 (0.46) CA2MAPK1CA1GRIK1GRIK2
Adipic Acid SCHEMBL28315411 0.92 FFAR4 (0.50) GPR84FFAR1MAPTPPARD
SCHEMBL6829832 0.91 CA2 (0.47) CA2MAPK1GRIK1GRIK2SLC1A2
SCHEMBL6829829 0.91 CA2 (0.47) CA2MAPK1GRIK1GRIK2SLC1A2
SCHEMBL6692423 0.91 CA2 (0.47) CA2MAPK1GRIK1GRIK2SLC1A2
SCHEMBL973522 0.87 CA2 (0.50) CA2MAPK1CA1GRIK1GRIK2
SCHEMBL973520 0.87 CA2 (0.50) CA2MAPK1CA1GRIK1GRIK2
SCHEMBL3156057 0.84 CA2 (0.52) CA2MAPK1CA1GRIK1GRIK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8389740-B2 Process for preparing ionic liquids by anion exchange BASF SE (DE) 2013-03-05 US disclosed
US-20100217010-A1 PROCESS FOR PREPARING IONIC LIQUIDS BY ANION EXCHANGE BASF SE (DE) 2010-08-26 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-20100217010-A1 PROCESS FOR PREPARING IONIC LIQUIDS BY ANION EXCHANGE NXF1, SLC1A5, NPM1 CA2 162/4885MAPK1 1729/4885CA1 521/4885

“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.