SCHEMBL6034516

SCHEMBL6034516

CCc1cccc(C=O)c1OCc1ccccc1

nearest known ligand 0.46

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ PTGER4 P35408 4/20 0.46
▸ PTGER3 P43115 4/20 0.46
▸ PTGER2 P43116 4/20 0.46
▸ BCHE P06276 11/20 0.46
▸ PTGER1 P34995 2/20 0.45
▸ CCNB2 O95067 1/20 0.45
▸ CDK1 P06493 1/20 0.45
▸ CDK4 P11802 1/20 0.45
▸ CCNB1 P14635 1/20 0.45
▸ CCND1 P24385 1/20 0.45
▸ CCNB3 Q8WWL7 1/20 0.45
▸ MAOA P21397 1/20 0.45
▸ MAOB P27338 1/20 0.45
▸ GAA P10253 1/20 0.43

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
SCHEMBL9369675 0.89 PTGER3 (0.47) PTGER4PTGER3PTGER2BCHEPTGER1
SCHEMBL28877513 0.87 CCNB2 (0.53) PTGER4PTGER3PTGER2BCHEPTGER1
SCHEMBL17772584 0.86 PTGER3 (0.45) PTGER4PTGER3PTGER2BCHEPTGER1
SCHEMBL25760584 0.85 PTGER4 (0.49) PTGER4PTGER3PTGER2BCHEPTGER1
SCHEMBL2574855 0.83 PTGER4 (0.55) PTGER4PTGER3PTGER2PTGER1CCNB2
SCHEMBL1539550 0.82 ALDH1A1 (0.43) PTGER4PTGER3PTGER2CDK4CCND1
SCHEMBL27754527 0.82 CA1 (0.44) GAA
SCHEMBL1050281 0.81 CCNB2 (0.59) PTGER4PTGER3PTGER2BCHEPTGER1
SCHEMBL16180183 0.80 LIPE (0.55) PTGER4PTGER3PTGER2PTGER1CCNB2
SCHEMBL1125006 0.80 KDM4E (0.60) PTGER4PTGER3PTGER2BCHECCNB2

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 4 patents. 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
EP-1513817-A1 1, 2-AZOLE DERIVATIVES WITH HYPOGLYCEMIC AND HYPOLIPIDEMIC ACTIVITY Takeda Pharmaceutical Company Limited (JP) 2005-03-16 — — EP disclosed
WO-2003099793-A9 1,2-AZOLE DERIVATIVES WITH HYPOGLYCEMIC AND HYPOLIPIDEMIC ACTIVITY TAKEDA PHARMACEUTICAL (JP) 2005-02-10 — — WO disclosed
WO-2003099793-A1 1,2-AZOLE DERIVATIVES WITH HYPOGLYCEMIC AND HYPOLIPIDEMIC ACTIVITY TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2003-12-04 — — WO 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 2147/4885PTGER3 4074/4885PTGER2 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.

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