SCHEMBL14201435

SCHEMBL14201435

NC(CF)(C(=O)O)C(O)CCCCc1ccccc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TRPA1 O75762 1/20 0.49
TRPV1 Q8NER1 1/20 0.44
FAAH O00519 6/20 0.43
CES1 P23141 3/20 0.43
GRM2 Q14416 2/20 0.42
GRM3 Q14832 2/20 0.42
S1PR2 O95136 1/20 0.42
S1PR4 O95977 1/20 0.42
S1PR1 P21453 1/20 0.42
S1PR3 Q99500 1/20 0.42
MAPT P10636 1/20 0.41
RXFP1 Q9HBX9 1/20 0.41
GRIK1 P39086 1/20 0.40
HDAC3 O15379 1/20 0.40
MAPK1 P28482 1/20 0.40
ADRA1A P35348 1/20 0.40
HDAC4 P56524 1/20 0.40
SLC6A3 Q01959 1/20 0.40
HDAC1 Q13547 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40

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
SCHEMBL14201480 0.90 SMN1; SMN2 (0.42) TRPA1GRM2GRM3SMN1; SMN2
SCHEMBL14145254 0.84 GRIK1 (0.47) TRPA1TRPV1GRM2GRM3MAPT
SCHEMBL4737745 0.84 GRIK1 (0.47) TRPA1TRPV1GRM2GRM3MAPT
SCHEMBL14201454 0.79 TRPA1 (0.48) TRPA1TRPV1FAAHGRM2GRM3
SCHEMBL14145251 0.79 TRPA1 (0.48) TRPA1TRPV1FAAHS1PR2S1PR4
SCHEMBL8667484 0.76 TRPA1 (0.54) TRPA1TRPV1FAAHCES1S1PR2
SCHEMBL9620397 0.76 TRPA1 (0.54) TRPA1TRPV1FAAHCES1S1PR2
SCHEMBL14201498 0.75 GRIK1 (0.50) TRPA1GRM2GRM3GRIK1HDAC3
SCHEMBL9620206 0.75 TRPA1 (0.56) TRPA1TRPV1FAAHCES1S1PR2
SCHEMBL14201434 0.75 GRIK1 (0.50) TRPA1GRM2GRM3GRIK1HDAC3

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-20080096799-A1 COMPOUNDS FOR AND METHODS OF TREATING INSULIN RESISTANCE AND INFLAMMATION FORBES MEDI-TECH (RESEARCH), INC. (US) 2008-04-24 US disclosed
WO-2008031032-A2 COMPOUNDS FOR AND METHODS OF TREATING INSULIN RESISTANCE AND INFLAMMATION TRANSITION THERAPEUTICS INC. (CA) 2008-03-13 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 (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-20080096799-A1 COMPOUNDS FOR AND METHODS OF TREATING INSULIN RESISTANCE AND INFLAMMATION PNLIP, CPT1A, CPT1B TRPA1 4445/4885TRPV1 3737/4885FAAH 1468/4885

“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.