SCHEMBL5110055

SCHEMBL5110055

CC(C)Oc1nc(COC2CCCCO2)sc1C(=O)NCc1ccc(Cl)cc1Cl

nearest known ligand 0.44

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 15/20 0.44
P2RX7 Q99572 5/20 0.41

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
SCHEMBL5114222 0.80 EPHX2 (0.45) EPHX2
SCHEMBL5109316 0.77 P2RX3 (0.41) EPHX2P2RX7
SCHEMBL5109516 0.74 HPGD (0.40)
SCHEMBL5114159 0.73 PPARG (0.42) EPHX2P2RX7
SCHEMBL5113934 0.72 PPARG (0.52) EPHX2
SCHEMBL5113332 0.65 EPHX2 (0.48) EPHX2P2RX7
SCHEMBL1563843 0.64 BDKRB2 (0.41) P2RX7
SCHEMBL5121206 0.63 TSHR (0.45) EPHX2P2RX7
SCHEMBL1564816 0.62 CCNA2 (0.38)
SCHEMBL5106751 0.62 TSHR (0.43) EPHX2P2RX7

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-20080051418-A1 Arylalkanoic Acid Derivative TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2008-02-28 US disclosed
EP-1829863-A1 ARYLALKANOIC ACID DERIVATIVE Takeda Pharmaceutical Company Limited (JP) 2007-09-05 EP 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-20080051418-A1 Arylalkanoic Acid Derivative INSR, NPY1R, GPR119 EPHX2 2573/4885P2RX7 730/4885

“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.