SCHEMBL2191501

SCHEMBL2191501

CC1CN(C(=O)OC(C)(C)C)CCN1C(=O)c1cccc(OCCC2CCCCC2)c1

nearest known ligand 0.48

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
SETD7 Q8WTS6 1/20 0.47
HTT P42858 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
HCRTR1 O43613 2/20 0.45
HCRTR2 O43614 2/20 0.45
GPR119 Q8TDV5 5/20 0.41
ALDH1A1 P00352 2/20 0.41
LMNA P02545 1/20 0.41
KDM4E B2RXH2 1/20 0.41
GHSR Q92847 2/20 0.40
USP30 Q70CQ3 1/20 0.40

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
SCHEMBL2195828 0.93 SETD7 (0.47) SETD7HTTL3MBTL1HCRTR1HCRTR2
SCHEMBL25120232 0.88 GPR119 (0.48) HCRTR1HCRTR2GPR119ALDH1A1LMNA
SCHEMBL30318930 0.88 GPR119 (0.48) HCRTR1HCRTR2GPR119ALDH1A1LMNA
SCHEMBL25120241 0.83 MEN1 (0.46) HTTL3MBTL1HCRTR1HCRTR2
SCHEMBL12509239 0.80 FAAH (0.47) HCRTR1HCRTR2ALDH1A1KDM4EGHSR
SCHEMBL12420609 0.79 HCRTR1 (0.49) HTTHCRTR1HCRTR2ALDH1A1LMNA
SCHEMBL25120379 0.78 NPC1 (0.54) HTTHCRTR1HCRTR2ALDH1A1LMNA
SCHEMBL25120242 0.78 HCRTR1 (0.46) HTTHCRTR1HCRTR2ALDH1A1LMNA
SCHEMBL3638878 0.77 SETD7 (0.65) SETD7HTTL3MBTL1GPR119KDM4E
SCHEMBL1102308 0.77 SETD7 (0.65) SETD7HTTL3MBTL1GPR119KDM4E

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-20110172230-A1 UREA COMPOUND OR SALT THEREOF ASTELLAS PHARMA INC. (JP) 2011-07-14 US disclosed
EP-2065369-A1 UREA COMPOUND OR SALT THEREOF Astellas Pharma Inc. (JP) 2009-06-03 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-20110172230-A1 UREA COMPOUND OR SALT THEREOF FAAH, FAAH2, UTS2R SETD7 343/4885HTT 2211/4885L3MBTL1 4818/4885

“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.