SCHEMBL5121631

SCHEMBL5121631

CCc1cccc(CC(=O)O)c1OCCn1cc(C(=O)NCc2ccc(Cl)cc2Cl)c(OC(C)C)n1

nearest known ligand 0.48

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PPARG P37231 2/20 0.48
EPHX2 P34913 5/20 0.39
TSHR P16473 2/20 0.38
LMNA P02545 2/20 0.38
MAPK1 P28482 1/20 0.38
NLRP1 Q9C000 1/20 0.38
P2RX7 Q99572 7/20 0.37
TEAD2 Q15562 1/20 0.36
RECQL P46063 1/20 0.36
ALOX5 P09917 1/20 0.35
SMN1; SMN2 Q16637 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
SCHEMBL5113109 0.93 PPARG (0.51) PPARGEPHX2TSHRLMNAP2RX7
SCHEMBL5120428 0.92 PPARG (0.58) PPARGEPHX2TSHRP2RX7RECQL
SCHEMBL5110656 0.92 EPHX2 (0.42) PPARGEPHX2TSHRLMNAMAPK1
SCHEMBL5115472 0.88 PPARG (0.59) PPARGEPHX2TSHRP2RX7TEAD2
SCHEMBL5113135 0.85 PPARG (0.45) PPARGEPHX2TSHRLMNAP2RX7
SCHEMBL5110205 0.84 TSHR (0.44) PPARGEPHX2TSHRLMNAMAPK1
SCHEMBL5118776 0.82 PTGDR2 (0.41) PPARGEPHX2LMNA
SCHEMBL5107718 0.81 PPARG (0.48) PPARGLMNANLRP1SMN1; SMN2
SCHEMBL5112185 0.81 EPHX2 (0.43) PPARGEPHX2TSHRLMNAP2RX7
SCHEMBL5121206 0.81 TSHR (0.45) PPARGEPHX2TSHRLMNAMAPK1

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 PPARG 52/4885EPHX2 2573/4885TSHR 98/4885

“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.