SCHEMBL4262500

SCHEMBL4262500

COc1cc(OCc2ccccc2)cc(OC)c1C=CC(=O)O

nearest known ligand 0.58

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.58
KDM4E B2RXH2 2/20 0.58
PKM P14618 1/20 0.58
SMN1; SMN2 Q16637 1/20 0.56
PTGER4 P35408 4/20 0.55
PTGER2 P43116 4/20 0.55
PTGER3 P43115 4/20 0.52
PTGER1 P34995 1/20 0.52
LMNA P02545 1/20 0.52
HDAC8 Q9BY41 1/20 0.52
GSK3B P49841 2/20 0.51
PTGS2 P35354 1/20 0.50
AKR1C3 P42330 2/20 0.49
APP P05067 2/20 0.49
BACE1 P56817 1/20 0.49
AKR1C2 P52895 1/20 0.49
PTGDR Q13258 1/20 0.49

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
SCHEMBL4262496 1.00 ALDH1A1 (0.58) ALDH1A1KDM4EPKMSMN1; SMN2PTGER4
SCHEMBL21957672 0.89 HDAC8 (0.58) ALDH1A1KDM4EPKMSMN1; SMN2PTGER4
SCHEMBL1745061 0.86 HDAC8 (0.53) LMNAHDAC8GSK3BAPP
SCHEMBL1745060 0.86 HDAC8 (0.53) LMNAHDAC8GSK3BAPP
SCHEMBL6035782 0.85 PTGER4 (0.60) ALDH1A1KDM4EPKMSMN1; SMN2PTGER4
SCHEMBL6035778 0.85 PTGER4 (0.60) ALDH1A1KDM4EPKMSMN1; SMN2PTGER4
SCHEMBL18538447 0.84 HDAC8 (0.65) ALDH1A1KDM4EPKMSMN1; SMN2PTGER4
SCHEMBL27705774 0.83 MAOB (0.71) ALDH1A1SMN1; SMN2APP
SCHEMBL27705775 0.83 MAOB (0.71) ALDH1A1SMN1; SMN2APP
SCHEMBL1745424 0.81 MAOB (0.53) SMN1; SMN2HDAC8

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1559422-B1 RECEPTOR FUNCTION CONTROLLING AGENT TAKEDA PHARMACEUTICAL (JP) 2014-04-30 EP disclosed
US-20090012093-A1 Receptor Function Regulator TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2009-01-08 US disclosed
EP-1559422-A1 RECEPTOR FUNCTION CONTROLLING AGENT Takeda Pharmaceutical Company Limited (JP) 2005-08-03 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-20090012093-A1 Receptor Function Regulator GPR119, GIPR, INSR ALDH1A1 4258/4885KDM4E 3200/4885PKM 4363/4885

“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.