SCHEMBL12509239

SCHEMBL12509239

CC1CN(C(=O)Nc2cccnc2)CCN1C(=O)c1cccc(OCCC2CCCCC2)c1

nearest known ligand 0.47

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
FAAH O00519 7/20 0.47
ALDH1A1 P00352 4/20 0.47
KDM4E B2RXH2 2/20 0.47
MAPK1 P28482 2/20 0.47
TSHR P16473 1/20 0.47
GRIN2B Q13224 1/20 0.43
CACNA1G O43497 1/20 0.42
CACNA1H O95180 1/20 0.42
CACNA1I Q9P0X4 1/20 0.42
CFTR P13569 1/20 0.41
GHSR Q92847 1/20 0.41
HCRTR1 O43613 1/20 0.41
HCRTR2 O43614 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
SCHEMBL12508557 0.94 MAPK1 (0.47) FAAHALDH1A1KDM4EMAPK1TSHR
SCHEMBL25120241 0.90 MEN1 (0.46) FAAHMAPK1HCRTR1HCRTR2
SCHEMBL12508835 0.89 ALDH1A1 (0.51) FAAHALDH1A1KDM4EMAPK1TSHR
SCHEMBL12509364 0.82 ABL1 (0.49) FAAHALDH1A1KDM4EMAPK1TSHR
SCHEMBL12509074 0.81 EPHX2 (0.51) FAAHALDH1A1MAPK1TSHR
SCHEMBL12509209 0.81 POLB (0.43) FAAHALDH1A1KDM4EHCRTR1HCRTR2
SCHEMBL12509410 0.81 ALDH1A1 (0.53) FAAHALDH1A1
SCHEMBL12509399 0.80 MGLL (0.51) FAAHALDH1A1KDM4EMAPK1TSHR
SCHEMBL25120242 0.80 HCRTR1 (0.46) FAAHALDH1A1KDM4EMAPK1CFTR
SCHEMBL12508869 0.80 MGLL (0.51) FAAHALDH1A1KDM4EMAPK1TSHR

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 FAAH 1/4885ALDH1A1 259/4885KDM4E 1146/4885

“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.