SCHEMBL9891012

SCHEMBL9891012

CC(C)(C)OC(=O)C(C)(CCC1CCN(C(=O)Cl)CC1)C(=O)OC(C)(C)C

nearest known ligand 0.38

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.36
PKM P14618 1/20 0.36
GPR119 Q8TDV5 5/20 0.36
NR1H2 P55055 1/20 0.36
FAAH O00519 1/20 0.36
HPGD P15428 1/20 0.35
RECQL P46063 1/20 0.34
EPHX1 P07099 1/20 0.34
HSD17B10 Q99714 1/20 0.34
HRH3 Q9Y5N1 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
SCHEMBL9892713 0.87 HPGD (0.49) KDM4EPKMGPR119NR1H2FAAH
SCHEMBL9891011 0.83 GNAI3 (0.38) KDM4EPKMGPR119FAAH
SCHEMBL18497332 0.78 KDM4E (0.49) KDM4EPKMGPR119FAAHHPGD
SCHEMBL15247133 0.77 GNAI3 (0.32) KDM4EPKMGPR119NR1H2FAAH
SCHEMBL9891010 0.76 GNAI3 (0.35) NR1H2
SCHEMBL15247425 0.76 HPGD (0.45) KDM4EPKMGPR119FAAHHPGD
SCHEMBL21577711 0.73 KDM4E (0.50) KDM4EPKM
SCHEMBL9891004 0.73 GAA (0.39)
SCHEMBL16510165 0.72 ALDH1A1 (0.31)
SCHEMBL15143956 0.72 HPGD (0.53) KDM4EPKMGPR119NR1H2FAAH

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120142722-A1 CONJUGATES OF CYTOTOXIC DRUGS APOSENSE LTD. (IL) 2012-06-07 US disclosed
WO-2010150255-A1 CONJUGATES OF CYTOTOXIC DRUGS APOSENSE LTD. (IL) 2010-12-29 WO 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-20120142722-A1 CONJUGATES OF CYTOTOXIC DRUGS CD47, MCL1, BAD KDM4E 1405/4885PKM 2761/4885GPR119 1767/4885

“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.