SCHEMBL4519067

SCHEMBL4519067

O=C(O)COc1ccc(CC2CCN(C3CCCCC3)C2=O)c(Cl)c1

nearest known ligand 0.50

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 1/20 0.50
FFAR1 O14842 6/20 0.42
MCL1 Q07820 1/20 0.40
HRH1 P35367 3/20 0.39
CCR3 P51677 3/20 0.39
PPARG P37231 1/20 0.39
PTGDR2 Q9Y5Y4 3/20 0.39
SIGMAR1 Q99720 1/20 0.38
KCNH2 Q12809 2/20 0.38
PTGDR Q13258 2/20 0.38
PTGER2 P43116 1/20 0.38
ALOX15 P16050 1/20 0.38
TSHR P16473 1/20 0.38
HSD17B10 Q99714 1/20 0.38

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
SCHEMBL4504147 0.92 HSD11B1 (0.50) HSD11B1FFAR1MCL1HRH1CCR3
SCHEMBL13674464 0.90 HSD11B1 (0.44) HSD11B1FFAR1PTGDR2SIGMAR1PTGDR
SCHEMBL4526129 0.88 SIGMAR1 (0.42) HSD11B1SIGMAR1TSHRHSD17B10
SCHEMBL4525800 0.88 HSD11B1 (0.47) HSD11B1FFAR1HRH1
SCHEMBL4509399 0.87 MCL1 (0.39) HSD11B1FFAR1MCL1HRH1CCR3
SCHEMBL4516252 0.87 HSD11B1 (0.55) HSD11B1FFAR1
SCHEMBL4521181 0.87 HSD11B1 (0.46) HSD11B1FFAR1
SCHEMBL4513450 0.86 HSD11B1 (0.48) HSD11B1
SCHEMBL4517793 0.86 HSD11B1 (0.52) HSD11B1TSHR
SCHEMBL4519338 0.86 HSD11B1 (0.60) HSD11B1HRH1

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-20090264650-A1 Prophylactic/Therapeutic Agent for Diabetes TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2009-10-22 US disclosed
US-20090264650-A1 Prophylactic/Therapeutic Agent for Diabetes TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2009-10-22 US disclosed
US-20090264650-A1 Prophylactic/Therapeutic Agent for Diabetes TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2009-10-22 US disclosed
EP-1864971-A1 PROPHYLACTIC/THERAPEUTIC AGENT FOR DIABETES Takeda Pharmaceutical Company Limited (JP) 2007-12-12 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-20090264650-A1 Prophylactic/Therapeutic Agent for Diabetes HSD11B1, HSD17B1, HSD11B2 HSD11B1 1/4885FFAR1 326/4885MCL1 4007/4885

“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.