SCHEMBL4522938

SCHEMBL4522938

NS(=O)(=O)c1ccc(C(=O)Nc2ccc(CC3CCN(C4C5CC6CC4CC(O)(C6)C5)C3=O)c(Cl)c2)cc1

nearest known ligand 0.49

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 3/20 0.49
CA2 P00918 10/20 0.38
CA1 P00915 9/20 0.38
CA9 Q16790 6/20 0.38
MEN1 O00255 3/20 0.37
KMT2A Q03164 3/20 0.37
CA7 P43166 2/20 0.37
CA12 O43570 4/20 0.36
ALDH1A1 P00352 2/20 0.35
KDM4E B2RXH2 1/20 0.35
KLK7 P49862 1/20 0.35
RXFP1 Q9HBX9 1/20 0.35
MAPT P10636 2/20 0.35
LMNA P02545 1/20 0.35

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
SCHEMBL4501901 0.89 HSD11B1 (0.60) HSD11B1KMT2A
SCHEMBL4510498 0.89 HSD11B1 (0.51) HSD11B1
SCHEMBL5547540 0.85 HSD11B1 (0.51) HSD11B1
SCHEMBL13674500 0.84 HSD11B1 (0.55) HSD11B1MAPTLMNA
SCHEMBL4501204 0.84 HSD11B1 (0.56) HSD11B1ALDH1A1KDM4E
SCHEMBL4515700 0.84 HSD11B1 (0.54) HSD11B1
Hydrochloric Acid SCHEMBL4524662 0.84 HSD11B1 (0.54) HSD11B1MAPTLMNA
SCHEMBL13674494 0.83 HSD11B1 (0.53) HSD11B1
Hydrochloric Acid SCHEMBL4507893 0.82 HSD11B1 (0.52) HSD11B1
SCHEMBL4511592 0.82 HSD11B1 (0.55) HSD11B1CA2CA1CA9CA12

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 1/4885CA2 1314/4885CA1 1529/4885

“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.