SCHEMBL5409090

SCHEMBL5409090

COC(=O)N1CCC[C@@H]1OC(C)C(=O)OC(C)(C)C

nearest known ligand 0.37

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 1/20 0.37
HSD17B10 Q99714 1/20 0.37
LMNA P02545 1/20 0.37
NPSR1 Q6W5P4 1/20 0.37
HPGD P15428 1/20 0.36
MEN1 O00255 2/20 0.36
KMT2A Q03164 2/20 0.36
NPC1 O15118 2/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
RAB9A P51151 2/20 0.35
ALDH1A1 P00352 1/20 0.35
MAPT P10636 1/20 0.35
MAPK1 P28482 1/20 0.35
HTT P42858 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
UCHL1 P09936 1/20 0.35
USP30 Q70CQ3 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
SCHEMBL5163237 0.88 RAB9A (0.40) HSD17B10HPGDMEN1KMT2ARAB9A
SCHEMBL5161584 0.86 HSD17B10 (0.39) EPHX1HSD17B10HPGDKMT2ANPC1
SCHEMBL5163678 0.78 ALOX5AP (0.36) HSD17B10LMNANPSR1MEN1KMT2A
SCHEMBL5160339 0.78 HCRTR2 (0.32) KMT2ASMN1; SMN2
SCHEMBL5161515 0.75 EPHX1 (0.39) EPHX1HSD17B10LMNANPSR1HPGD
SCHEMBL14457242 0.73 HSD17B10 (0.50) EPHX1HSD17B10LMNANPSR1HPGD
SCHEMBL925960 0.73 HSD17B10 (0.50) EPHX1HSD17B10LMNANPSR1HPGD
SCHEMBL9977242 0.73 HSD17B10 (0.50) EPHX1HSD17B10LMNANPSR1HPGD
SCHEMBL5409095 0.73 USP30 (0.38) EPHX1HPGDMEN1KMT2ANPC1
SCHEMBL7527261 0.72 TSHR (0.45) RAB9AL3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070232601-A1 Vla-4 Inhibitor DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2007-10-04 US 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-20070232601-A1 Vla-4 Inhibitor VCAM1, ITGB4, ITGA4 EPHX1 3451/4885HSD17B10 3097/4885LMNA 4162/4885

“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.