SCHEMBL2936852

SCHEMBL2936852

CSCCC1NC2(CCN(C(=O)c3ccc(OC(F)(F)F)cc3)CC2)N(CC(=O)O)C1=O

nearest known ligand 0.44

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 2/20 0.44
HSD11B1 P28845 1/20 0.39
EPHX2 P34913 4/20 0.39
MGLL Q99685 2/20 0.39
LSS P48449 1/20 0.39
MMP2 P08253 1/20 0.37
MMP9 P14780 1/20 0.37
ENPP2 Q13822 1/20 0.37
ATXN2 Q99700 1/20 0.37
CACNA1B Q00975 1/20 0.37
LIPE Q05469 2/20 0.36
EGLN1 Q9GZT9 1/20 0.36
MAPK8 P45983 1/20 0.35
MAPK10 P53779 1/20 0.35
HTR2B P41595 1/20 0.35
NAMPT P43490 1/20 0.35
MAPK7 Q13164 1/20 0.35

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
SCHEMBL2943345 0.89 MEN1 (0.40) HSD11B1EPHX2MGLL
SCHEMBL2943359 0.86 HPGD (0.41)
SCHEMBL1802416 0.84 HRH3 (0.48) HRH3HSD11B1EPHX2MGLLLSS
SCHEMBL2942484 0.83 SMN1; SMN2 (0.41) HSD11B1MGLL
SCHEMBL3998893 0.80 HRH3 (0.48) HRH3HSD11B1EPHX2MGLLLSS
SCHEMBL2943567 0.79 PROKR1 (0.36) MGLL
SCHEMBL2936054 0.78 SCD (0.39) CACNA1BHTR2B
SCHEMBL2942901 0.78 CHRNA4 (0.39) NAMPT
SCHEMBL2939777 0.78 MAPT (0.43) HSD11B1CACNA1BNAMPT
SCHEMBL1803504 0.78 POLB (0.41)

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
EP-1730147-B1 SUBSTITUTED 1,4,8-TRIAZASPIRO[4,5]DECAN-2-ON COMPOUNDS FOR USE IN THE TREATMENT OF OBESITY GRUENENTHAL GMBH (DE) 2010-02-03 EP claimed
US-20070015784-A1 Subsitituted 1,4,8- triazaspiro [4,5]decan-2-one compounds GRUENENTHAL GMBH (DE) 2007-01-18 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-20070015784-A1 Subsitituted 1,4,8- triazaspiro [4,5]decan-2-one compounds SI, SSTR4, SLC10A2 HRH3 3410/4885HSD11B1 2681/4885EPHX2 4594/4885

“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.