SCHEMBL6035778

SCHEMBL6035778

COc1cccc(OCc2ccccc2)c1/C=C/C(=O)O

nearest known ligand 0.60

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PTGER4 P35408 5/20 0.60
PTGER2 P43116 5/20 0.60
PTGER3 P43115 4/20 0.60
PTGER1 P34995 2/20 0.60
KDM4E B2RXH2 2/20 0.53
LMNA P02545 1/20 0.53
ABCG2 Q9UNQ0 1/20 0.52
RXRA P19793 1/20 0.52
ALDH1A1 P00352 3/20 0.52
MRGPRX4 Q96LA9 1/20 0.52
PKM P14618 1/20 0.52
ATM Q13315 1/20 0.51
APP P05067 2/20 0.50
HDAC8 Q9BY41 1/20 0.50
SMN1; SMN2 Q16637 1/20 0.50
RECQL P46063 1/20 0.50
AKR1C3 P42330 2/20 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
SCHEMBL6035782 1.00 PTGER4 (0.60) PTGER4PTGER2PTGER3PTGER1KDM4E
SCHEMBL16265416 0.85 ABCG2 (0.69) KDM4ELMNAABCG2ALDH1A1PKM
SCHEMBL16265418 0.85 ABCG2 (0.69) KDM4ELMNAABCG2ALDH1A1PKM
SCHEMBL4262496 0.85 ALDH1A1 (0.58) PTGER4PTGER2PTGER3PTGER1KDM4E
SCHEMBL21957672 0.85 HDAC8 (0.58) PTGER4PTGER2PTGER3PTGER1KDM4E
SCHEMBL4262500 0.85 ALDH1A1 (0.58) PTGER4PTGER2PTGER3PTGER1KDM4E
SCHEMBL10870465 0.84 PTGER1 (0.54) PTGER4PTGER2PTGER3PTGER1KDM4E
SCHEMBL10870470 0.84 PTGER1 (0.54) PTGER4PTGER2PTGER3PTGER1KDM4E
SCHEMBL4981344 0.81 MAPT (0.51) ABCG2RXRAMRGPRX4ATMAPP
SCHEMBL4981349 0.81 MAPT (0.51) ABCG2RXRAMRGPRX4ATMAPP

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 PTGER4 2147/4885PTGER2 4649/4885PTGER3 4074/4885

“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.