SCHEMBL6036142

SCHEMBL6036142

COc1ccc(OCc2ccccc2)c(C=CC(=O)O)c1

nearest known ligand 0.65

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
HDAC8 Q9BY41 2/20 0.65
PTGER4 P35408 6/20 0.64
PTGER2 P43116 6/20 0.64
PTGER3 P43115 6/20 0.64
PTGER1 P34995 4/20 0.64
LTB4R Q15722 1/20 0.58
LTB4R2 Q9NPC1 1/20 0.58
KDM4E B2RXH2 2/20 0.56
LMNA P02545 1/20 0.56
JUN P05412 1/20 0.55
NFKB1 P19838 1/20 0.55
AKR1C3 P42330 1/20 0.54
GAA P10253 1/20 0.53
PPARG P37231 1/20 0.53
PTGDR Q13258 1/20 0.53
ALDH1A1 P00352 1/20 0.52
PKM P14618 1/20 0.52

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
SCHEMBL6036139 1.00 HDAC8 (0.65) HDAC8PTGER4PTGER2PTGER3PTGER1
SCHEMBL344657 0.91 PTGER3 (0.68) HDAC8PTGER4PTGER2PTGER3PTGER1
SCHEMBL344658 0.91 PTGER3 (0.68) HDAC8PTGER4PTGER2PTGER3PTGER1
SCHEMBL6035015 0.90 HDAC8 (0.80) HDAC8PTGER4PTGER2PTGER3PTGER1
SCHEMBL6035013 0.90 HDAC8 (0.80) HDAC8PTGER4PTGER2PTGER3PTGER1
SCHEMBL4031129 0.89 KDM4E (0.65) HDAC8PTGER4PTGER2PTGER3PTGER1
SCHEMBL4031132 0.89 KDM4E (0.65) HDAC8PTGER4PTGER2PTGER3PTGER1
SCHEMBL6452840 0.88 APP (0.67) HDAC8PTGER4PTGER2PTGER3PTGER1
SCHEMBL4029676 0.86 KDM4E (0.65) HDAC8PTGER4PTGER2PTGER3PTGER1
SCHEMBL4029671 0.86 KDM4E (0.65) HDAC8PTGER4PTGER2PTGER3PTGER1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20060148858-A1 1, 2-Azole derivatives with hypoglycemic and hypolipidemic activity TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2006-07-06 US 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-20060148858-A1 1, 2-Azole derivatives with hypoglycemic and hypolipidemic activity GPR119, SLC5A1, CYP4B1 HDAC8 876/4885PTGER4 2147/4885PTGER2 4649/4885

“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.