SCHEMBL1589872

SCHEMBL1589872

CCOC(=O)C1(CCOC)CCC(OCc2ccccc2)CC1

nearest known ligand 0.56

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.51
KMT2A Q03164 6/20 0.49
MEN1 O00255 5/20 0.49
KDM4E B2RXH2 2/20 0.49
LMNA P02545 4/20 0.47
MAPT P10636 2/20 0.47
POLB P06746 2/20 0.47
L3MBTL1 Q9Y468 1/20 0.47
ATM Q13315 1/20 0.47
PKM P14618 1/20 0.47
P4HB P07237 1/20 0.46
RAB9A P51151 2/20 0.46
NPC1 O15118 1/20 0.46
NPY1R P25929 1/20 0.45
DPP4 P27487 1/20 0.45
OPRM1 P35372 1/20 0.45
OPRL1 P41146 1/20 0.45

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
SCHEMBL5039 1.00 ALDH1A1 (0.51) ALDH1A1KMT2AMEN1KDM4ELMNA
SCHEMBL27377484 0.81 OPRM1 (0.51) KMT2AMEN1KDM4ELMNAMAPT
SCHEMBL27377447 0.81 OPRM1 (0.51) KMT2AMEN1KDM4ELMNAMAPT
SCHEMBL20295173 0.78 LMNA (0.53) ALDH1A1KMT2AMEN1KDM4ELMNA
SCHEMBL8536152 0.77 OPRM1 (0.47) ALDH1A1KMT2AMEN1KDM4ELMNA
SCHEMBL12277199 0.77 LMNA (0.46) ALDH1A1KMT2AMEN1KDM4ELMNA
SCHEMBL14661822 0.77 OPRM1 (0.47) KDM4ELMNAMAPTPOLBPKM
SCHEMBL18063140 0.77 KDM4E (0.45) ALDH1A1KMT2AMEN1KDM4ELMNA
SCHEMBL609304 0.77 KDM4E (0.79) ALDH1A1KMT2AMEN1KDM4ELMNA
SCHEMBL2800622 0.77 LMNA (0.43) ALDH1A1KMT2AMEN1KDM4ELMNA

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
EP-2488493-B1 SPIRO-CONDENSED CYCLOHEXANE DERIVATIVES AS HSL INHIBITORS USEFUL FOR THE TREATMENT OF DIABETES HOFFMANN LA ROCHE (CH) 2015-04-15 EP disclosed
US-8440710-B2 HSL inhibitors useful in the treatment of diabetes HOFFMANN-LA ROCHE INC. (US) 2013-05-14 US disclosed
US-20110092512-A1 NEW HSL INHIBITORS USEFUL IN THE TREATMENT OF DIABETES F. HOFFMANN-LA ROCHE AG (CH) 2011-04-21 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-20110092512-A1 NEW HSL INHIBITORS USEFUL IN THE TREATMENT OF DIABETES LPL, MGLL, LIPE ALDH1A1 1748/4885KMT2A 4540/4885MEN1 4517/4885

“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.