SCHEMBL2939906

SCHEMBL2939906

CSCCC1NC2(CCN(C(=O)CC(C)(C)C)CC2)N(CC(=O)O)C1=O

nearest known ligand 0.35

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
TPSAB1 Q15661 1/20 0.32
TPSD1 Q9BZJ3 1/20 0.32
TPSG1 Q9NRR2 1/20 0.32
HDAC8 Q9BY41 2/20 0.30
ALDH1A1 P00352 1/20 0.30
HTT P42858 1/20 0.30
MAPT P10636 1/20 0.30

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
SCHEMBL1800410 0.89 OPRM1 (0.32) HDAC8ALDH1A1HTTMAPT
SCHEMBL2943562 0.87 CYP3A4 (0.36) HDAC8ALDH1A1HTTMAPT
SCHEMBL1802223 0.86
SCHEMBL2940210 0.82 ITGB3 (0.36) HDAC8ALDH1A1HTT
SCHEMBL2943359 0.81 HPGD (0.41) ALDH1A1HTT
SCHEMBL1803756 0.81 TPSAB1 (0.31) TPSAB1TPSD1TPSG1
SCHEMBL4032819 0.80 POLB (0.34) ALDH1A1HTTMAPT
SCHEMBL2932751 0.79 NAMPT (0.38) ALDH1A1HTT
SCHEMBL4036735 0.79 MAPT (0.43) ALDH1A1HTTMAPT
SCHEMBL2943345 0.78 MEN1 (0.40) ALDH1A1

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 TPSAB1 505/4885TPSD1 435/4885TPSG1 790/4885

“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.