SCHEMBL4504147

SCHEMBL4504147

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

nearest known ligand 0.50

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 1/20 0.50
MCL1 Q07820 1/20 0.43
HRH1 P35367 3/20 0.39
CCR3 P51677 3/20 0.39
NPC1 O15118 2/20 0.39
RAB9A P51151 2/20 0.39
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
ATF4 P18848 1/20 0.39
PTGDR2 Q9Y5Y4 3/20 0.39
SIGMAR1 Q99720 1/20 0.38
FFAR1 O14842 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
SCHEMBL4519067 0.92 HSD11B1 (0.50) HSD11B1MCL1HRH1CCR3PTGDR2
SCHEMBL13674465 0.90 HSD11B1 (0.44) HSD11B1NPC1RAB9AMEN1KMT2A
SCHEMBL4507215 0.88 HSD11B1 (0.47) HSD11B1HRH1SMN1; SMN2ATF4
SCHEMBL4518087 0.86 HSD11B1 (0.52) HSD11B1MEN1KMT2ATSHR
SCHEMBL4509824 0.84 HSD11B1 (0.46) HSD11B1
SCHEMBL3548268 0.84 HSD11B1 (0.48) HSD11B1MCL1HRH1CCR3MEN1
SCHEMBL13674464 0.82 HSD11B1 (0.44) HSD11B1NPC1RAB9AMEN1KMT2A
SCHEMBL4511563 0.81 HSD11B1 (0.54) HSD11B1SIGMAR1
SCHEMBL4526129 0.80 SIGMAR1 (0.42) HSD11B1NPC1RAB9AMEN1KMT2A
SCHEMBL4509399 0.79 MCL1 (0.39) HSD11B1MCL1HRH1CCR3FFAR1

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 1/4885MCL1 4007/4885HRH1 2923/4885

“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.