SCHEMBL16319014

SCHEMBL16319014

CCOC(=O)CCc1ccc(C)c(O)c1

nearest known ligand 0.61

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CYP4F2 P78329 2/20 0.61
CYP4A11 Q02928 2/20 0.61
APP P05067 2/20 0.58
CYP4Z1 Q86W10 1/20 0.49
IAPP P10997 3/20 0.49
PDE3B Q13370 1/20 0.47
PDE3A Q14432 1/20 0.47
P2RY12 Q9H244 1/20 0.47
YWHAG P61981 1/20 0.43
HRH3 Q9Y5N1 1/20 0.42
TDP1 Q9NUW8 1/20 0.42
ALDH1A1 P00352 2/20 0.42
KDM4E B2RXH2 1/20 0.41
GLA P06280 1/20 0.41
GAA P10253 1/20 0.41
HPGD P15428 1/20 0.41
CASP1 P29466 1/20 0.41
CASP7 P55210 1/20 0.41
HSD17B10 Q99714 1/20 0.41

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
SCHEMBL30291871 0.89 APP (0.73) CYP4F2CYP4A11APPCYP4Z1IAPP
SCHEMBL490911 0.89 APP (0.73) CYP4F2CYP4A11APPCYP4Z1IAPP
SCHEMBL1549436 0.87 CYP4F2 (0.61) CYP4F2CYP4A11APPCYP4Z1IAPP
SCHEMBL27972225 0.85 APP (0.51) CYP4F2CYP4A11APPIAPPALDH1A1
SCHEMBL5274836 0.84 CYP4F2 (0.58) CYP4F2CYP4A11APPCYP4Z1IAPP
SCHEMBL27915291 0.84 CYP4F2 (0.58) CYP4F2CYP4A11APPCYP4Z1IAPP
SCHEMBL9925913 0.84 CYP4F2 (0.58) CYP4F2CYP4A11APPCYP4Z1IAPP
SCHEMBL3740648 0.84 CYP4F2 (0.58) CYP4F2CYP4A11APPCYP4Z1IAPP
SCHEMBL8984895 0.84 CYP4F2 (0.61) CYP4F2CYP4A11APPCYP4Z1IAPP
SCHEMBL1008790 0.83 YWHAG (0.53) CYP4F2CYP4A11CYP4Z1YWHAGTDP1

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
US-9181186-B2 Aromatic ring compound TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2015-11-10 US disclosed
US-20150045378-A1 AROMATIC RING COMPOUND TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2015-02-12 US disclosed
EP-2816032-A1 AROMATIC RING COMPOUND Takeda Pharmaceutical Company Limited (JP) 2014-12-24 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-20150045378-A1 AROMATIC RING COMPOUND GPR119, GPR27, GPR4 CYP4F2 2229/4885CYP4A11 304/4885APP 1420/4885

“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.