SCHEMBL4514812

SCHEMBL4514812

CC(=O)OCC(=O)Nc1ccc(CC2CCN(C3CCCCC3)C2=O)c(Cl)c1

nearest known ligand 0.46

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.46
L3MBTL1 Q9Y468 3/20 0.46
MEN1 O00255 1/20 0.46
GAA P10253 1/20 0.46
KMT2A Q03164 1/20 0.46
HSD11B1 P28845 1/20 0.42
POLB P06746 2/20 0.41
HPGD P15428 3/20 0.40
KDM4E B2RXH2 1/20 0.40
HSD17B10 Q99714 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
PKM P14618 1/20 0.39
ATM Q13315 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
SCHEMBL4513595 0.87 HSD11B1 (0.46) ALDH1A1HSD11B1POLBHPGDKDM4E
SCHEMBL4509056 0.86 HSD11B1 (0.43) ALDH1A1L3MBTL1MEN1GAAKMT2A
SCHEMBL4527041 0.85 LMNA (0.46) ALDH1A1L3MBTL1MEN1GAAKMT2A
SCHEMBL4510127 0.84 HSD11B1 (0.47) ALDH1A1L3MBTL1MEN1KMT2AHSD11B1
SCHEMBL4515294 0.83 HSD11B1 (0.43) ALDH1A1KMT2AHSD11B1POLBHPGD
SCHEMBL13674559 0.83 HSD11B1 (0.43) ALDH1A1HSD11B1POLBHPGDKDM4E
SCHEMBL4516607 0.82 HSD11B1 (0.44) ALDH1A1MEN1KMT2AHSD11B1POLB
SCHEMBL5543818 0.82 HSD11B1 (0.43) ALDH1A1L3MBTL1MEN1KMT2AHSD11B1
SCHEMBL4505773 0.82 NPC1 (0.53) ALDH1A1L3MBTL1MEN1KMT2AHSD11B1
Hydrochloric Acid SCHEMBL4515008 0.82 HSD11B1 (0.42) ALDH1A1HSD11B1POLBHPGDKDM4E

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 ALDH1A1 51/4885L3MBTL1 3517/4885MEN1 1254/4885

“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.