SCHEMBL565074

SCHEMBL565074

FC(F)(F)c1ccccc1-c1ccc(CCc2ccc3c(c2)CCN3)cc1

nearest known ligand 0.44

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
SLC13A5 Q86YT5 1/20 0.42
CNR2 P34972 4/20 0.39
TRPA1 O75762 2/20 0.39
TRPM8 Q7Z2W7 1/20 0.39
S1PR1 P21453 1/20 0.38
PPARG P37231 1/20 0.37
PPARA Q07869 1/20 0.37
HSD11B1 P28845 1/20 0.37
AR P10275 2/20 0.36
DRD2 P14416 1/20 0.36
DRD4 P21917 1/20 0.36
TRPV1 Q8NER1 1/20 0.36
SCN9A Q15858 1/20 0.36
FFAR1 O14842 1/20 0.35

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
SCHEMBL13598220 0.78 S1PR1 (0.43) S1PR1
Hydrochloric Acid SCHEMBL3901642 0.78 S1PR1 (0.42) S1PR1
SCHEMBL13598189 0.74 MAOA (0.45) FFAR1
Hydrochloric Acid SCHEMBL3901966 0.74 MAOA (0.44) FFAR1
SCHEMBL24286867 0.70 AR (0.43) TRPA1TRPM8ARSCN9A
SCHEMBL566056 0.70 FFAR1 (0.46) SLC13A5CNR2TRPA1TRPM8S1PR1
SCHEMBL7461260 0.70 SLC13A5 (0.53) SLC13A5CNR2TRPA1TRPM8PPARG
SCHEMBL2097625 0.70 SLC13A5 (0.53) SLC13A5CNR2TRPA1TRPM8PPARG
SCHEMBL22304414 0.68 AR (0.58) SLC13A5CNR2TRPA1TRPM8PPARG
SCHEMBL8529985 0.68 DRD2 (0.50) CNR2S1PR1DRD2DRD4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9181182-B2 S1P receptors modulators AKAAL PHARMA PTY LTD (AU) 2015-11-10 US disclosed
US-20120034270-A1 S1P Receptors Modulators AKAAL PHARMA PTY LTD (AU) 2012-02-09 US disclosed
EP-2344446-A1 S1P RECEPTORS MODULATORS Akaal Pharma Pty Ltd (AU) 2011-07-20 EP disclosed
WO-2010042998-A1 S1P RECEPTORS MODULATORS AKAAL PHARMA PTY LTD (AU) 2010-04-22 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-20120034270-A1 S1P Receptors Modulators S1PR1, S1PR5, S1PR3 SLC13A5 4238/4885CNR2 35/4885TRPA1 650/4885

“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.