SCHEMBL2196624

SCHEMBL2196624

CC(C)(C)OC(=O)N1CCN(C(=O)c2ccnc(OCCC3CCCCC3)c2)CC1

nearest known ligand 0.47

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.47
KMT2A Q03164 2/20 0.47
ABL1 P00519 1/20 0.45
RIN1 Q13671 1/20 0.45
POLB P06746 1/20 0.44
FAAH O00519 1/20 0.44
GPR119 Q8TDV5 8/20 0.43
ALDH1A1 P00352 1/20 0.43
GAA P10253 1/20 0.43
HPGD P15428 1/20 0.43
CHEK2 O96017 1/20 0.43
PROKR1 Q8TCW9 1/20 0.43
SCN9A Q15858 1/20 0.41

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
SCHEMBL30318930 0.84 GPR119 (0.48) MEN1KMT2AGPR119ALDH1A1
SCHEMBL25120232 0.84 GPR119 (0.48) MEN1KMT2AGPR119ALDH1A1
SCHEMBL12420773 0.83 PROKR1 (0.43) ALDH1A1HPGDPROKR1SCN9A
Hydrochloric Acid SCHEMBL2195999 0.82 PROKR1 (0.42) ALDH1A1HPGDPROKR1SCN9A
SCHEMBL2198288 0.82 SCN9A (0.52) MEN1KMT2AABL1RIN1GPR119
SCHEMBL12509165 0.80 ALDH1A1 (0.41) MEN1KMT2AFAAHALDH1A1HPGD
SCHEMBL25120372 0.79 NAMPT (0.48) FAAHALDH1A1GAA
SCHEMBL12508542 0.78 FAAH (0.43) FAAHALDH1A1
SCHEMBL12509388 0.78 ALDH1A1 (0.42) KMT2AFAAHALDH1A1PROKR1
SCHEMBL12509168 0.78 FAAH (0.43) MEN1KMT2AFAAHALDH1A1HPGD

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 MEN1 4707/4885KMT2A 1156/4885ABL1 3355/4885

“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.