SCHEMBL13780263

SCHEMBL13780263

CC(C)(C)OC(=O)N1CCC[C@@H]1C(=O)N1CCN(C(=O)OCc2ccccc2)CC1

nearest known ligand 0.61

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 1/20 0.58
PREP P48147 5/20 0.58
KLK7 P49862 1/20 0.55
UCHL1 P09936 1/20 0.54
MEN1 O00255 1/20 0.52
KMT2A Q03164 1/20 0.52
HRH2 P25021 1/20 0.52
HRH1 P35367 1/20 0.52
NPC1 O15118 2/20 0.51
RAB9A P51151 2/20 0.51
SMN1; SMN2 Q16637 2/20 0.51
PARP1 P09874 1/20 0.50
NPSR1 Q6W5P4 1/20 0.50

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
SCHEMBL4974458 0.97 HSD17B10 (0.55) HSD17B10PREPKLK7UCHL1NPC1
SCHEMBL6201175 0.94 PREP (0.58) HSD17B10PREPKLK7UCHL1NPSR1
SCHEMBL6201170 0.94 PREP (0.58) HSD17B10PREPKLK7UCHL1NPSR1
SCHEMBL2960273 0.93 PREP (0.57) HSD17B10PREPKLK7NPSR1
SCHEMBL9354156 0.88 PREP (0.64) PREPMEN1KMT2ANPC1RAB9A
SCHEMBL11262912 0.88 PREP (0.69) HSD17B10PREPKLK7KMT2ANPSR1
SCHEMBL11262909 0.88 PREP (0.69) HSD17B10PREPKLK7KMT2ANPSR1
SCHEMBL3396768 0.86 HSD17B10 (0.60) HSD17B10KLK7UCHL1MEN1KMT2A
SCHEMBL7307432 0.86 KLK7 (0.61) HSD17B10PREPKLK7MEN1KMT2A
SCHEMBL9609458 0.86 KLK7 (0.61) HSD17B10PREPKLK7MEN1KMT2A

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090182140-A1 Alicyclic Heterocyclic Compound MITSUBISHI TANABE PHARMA CORPORATION (JP) 2009-07-16 US disclosed
US-20090182140-A1 Alicyclic Heterocyclic Compound MITSUBISHI TANABE PHARMA CORPORATION (JP) 2009-07-16 US disclosed
EP-1970373-A1 ALICYCLIC HETEROCYCLIC COMPOUND Mitsubishi Tanabe Pharma Corporation (JP) 2008-09-17 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-20090182140-A1 Alicyclic Heterocyclic Compound CCR4, CCR1, HRH4 HSD17B10 2070/4885PREP 4080/4885KLK7 4126/4885

“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.