SCHEMBL4524141

SCHEMBL4524141

O=C(CNC(=O)c1ccccc1)Nc1ccc(CC2CCN(C3C4CC5CC3CC(O)(C5)C4)C2=O)c(Cl)c1

nearest known ligand 0.55

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 6/20 0.55
BRD4 O60885 1/20 0.38
ATAD2 Q6PL18 1/20 0.38
MAPK8 P45983 2/20 0.38
HTT P42858 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
MEN1 O00255 2/20 0.36
KMT2A Q03164 2/20 0.36
GAA P10253 1/20 0.36
NAMPT P43490 1/20 0.36
EPHX2 P34913 1/20 0.35
CCR2 P41597 1/20 0.33
MCHR1 Q99705 1/20 0.33
ALDH1A1 P00352 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33

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 0.92 HSD11B1 (0.60) HSD11B1MAPK8KMT2AEPHX2
SCHEMBL4511293 0.92 HSD11B1 (0.54) HSD11B1MAPK8MEN1KMT2AGAA
SCHEMBL4515134 0.88 HSD11B1 (0.63) HSD11B1HTTL3MBTL1MEN1KMT2A
SCHEMBL4501764 0.87 HSD11B1 (0.54) HSD11B1MAPK8MEN1KMT2AEPHX2
SCHEMBL13674500 0.86 HSD11B1 (0.55) HSD11B1EPHX2
SCHEMBL4518194 0.85 HSD11B1 (0.54) HSD11B1MAPK8MEN1KMT2AEPHX2
SCHEMBL13674499 0.85 HSD11B1 (0.47) HSD11B1MEN1KMT2AGAAEPHX2
Hydrochloric Acid SCHEMBL4524662 0.85 HSD11B1 (0.54) HSD11B1EPHX2
SCHEMBL4511592 0.85 HSD11B1 (0.55) HSD11B1HTTL3MBTL1GAAALDH1A1
SCHEMBL4501204 0.84 HSD11B1 (0.56) HSD11B1ATAD2L3MBTL1EPHX2ALDH1A1

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 1/4885BRD4 3776/4885ATAD2 3348/4885

“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.