SCHEMBL5119409

SCHEMBL5119409

CCCOc1ccc(/C=C/C(=O)O)c(OCc2ccccc2)c1

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HDAC8 Q9BY41 3/20 0.61
▸ PTGER3 P43115 5/20 0.60
▸ PTGER4 P35408 5/20 0.60
▸ PTGER2 P43116 5/20 0.60
▸ PTGER1 P34995 4/20 0.60
▸ PLA2G2D Q9UNK4 1/20 0.57
▸ KDM4E B2RXH2 3/20 0.53
▸ LMNA P02545 1/20 0.53
▸ PTGDR Q13258 1/20 0.53
▸ ALDH1A1 P00352 2/20 0.52
▸ PKM P14618 1/20 0.52
▸ MEN1 O00255 1/20 0.52
▸ GAA P10253 1/20 0.52
▸ KMT2A Q03164 1/20 0.52
▸ APP P05067 1/20 0.48
▸ MAPT P10636 1/20 0.48
▸ BACE1 P56817 1/20 0.48
▸ CYP1A1 P04798 1/20 0.48
▸ CYP1B1 Q16678 1/20 0.48
▸ LTB4R Q15722 1/20 0.47

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
SCHEMBL5119417 1.00 HDAC8 (0.61) HDAC8PTGER3PTGER4PTGER2PTGER1
SCHEMBL7909151 0.90 PTGER3 (0.68) HDAC8PTGER3PTGER4PTGER2PTGER1
SCHEMBL7191225 0.90 PTGER3 (0.68) HDAC8PTGER3PTGER4PTGER2PTGER1
SCHEMBL3208391 0.89 HDAC8 (0.64) HDAC8PTGER3PTGER4PTGER2PTGER1
SCHEMBL3208404 0.89 HDAC8 (0.64) HDAC8PTGER3PTGER4PTGER2PTGER1
SCHEMBL6035015 0.86 HDAC8 (0.80) HDAC8PTGER3PTGER4PTGER2PTGER1
SCHEMBL6035013 0.86 HDAC8 (0.80) HDAC8PTGER3PTGER4PTGER2PTGER1
SCHEMBL1712815 0.86 POLB (0.55) HDAC8KDM4ELMNAALDH1A1MEN1
SCHEMBL3218760 0.86 HDAC8 (0.65) HDAC8PTGER3PTGER4PTGER2PTGER1
SCHEMBL3218772 0.86 HDAC8 (0.65) HDAC8PTGER3PTGER4PTGER2PTGER1

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 HDAC8 156/4885PTGER3 1565/4885PTGER4 1928/4885

“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.

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