SCHEMBL4515992

SCHEMBL4515992

NC(=O)c1ccc(-c2ccc(CC3CCN(C4C5CC6CC4CC(O)(C6)C5)C3=O)c(Cl)c2)cc1

nearest known ligand 0.55

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 13/20 0.55
JAK1 P23458 1/20 0.34
JAK3 P52333 1/20 0.34
PDE4A P27815 1/20 0.33
PDE4B Q07343 1/20 0.33
PDE4C Q08493 1/20 0.33
PDE4D Q08499 1/20 0.33
P2RX7 Q99572 1/20 0.33
MAPK8 P45983 1/20 0.32
HDAC6 Q9UBN7 1/20 0.32

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
SCHEMBL4524651 0.92 HSD11B1 (0.59) HSD11B1P2RX7MAPK8
SCHEMBL4524294 0.89 HSD11B1 (0.59) HSD11B1
SCHEMBL5547540 0.88 HSD11B1 (0.51) HSD11B1MAPK8HDAC6
SCHEMBL4519335 0.85 HSD11B1 (0.62) HSD11B1
SCHEMBL4513867 0.84 HSD11B1 (0.64) HSD11B1MAPK8
SCHEMBL4511122 0.84 HSD11B1 (0.63) HSD11B1
SCHEMBL4513385 0.84 HSD11B1 (0.63) HSD11B1P2RX7
SCHEMBL4510016 0.83 HSD11B1 (0.52) HSD11B1
SCHEMBL4514653 0.83 HSD11B1 (0.56) HSD11B1
SCHEMBL4514948 0.83 HSD11B1 (0.55) HSD11B1

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 1/4885JAK1 3768/4885JAK3 4841/4885

“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.