SCHEMBL3925468

SCHEMBL3925468

CCC(C(=O)O)N1C(=O)C(Cc2ccccc2)NC12CCN(S(=O)(=O)c1ccccc1S(C)(=O)=O)CC2

nearest known ligand 0.37

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MMP2 P08253 3/20 0.37
MMP13 P45452 1/20 0.37
SMN1; SMN2 Q16637 3/20 0.35
GAA P10253 1/20 0.35
TSHR P16473 1/20 0.35
HTT P42858 1/20 0.35
MDM2 Q00987 1/20 0.34
ALDH1A1 P00352 3/20 0.34
KDM4E B2RXH2 1/20 0.34
USP2 O75604 1/20 0.34
PKM P14618 1/20 0.34
ALOX15 P16050 1/20 0.34
HSD17B10 Q99714 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
ACLY P53396 1/20 0.34
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
LMNA P02545 1/20 0.33

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
SCHEMBL3916032 0.90 CYP2D6 (0.42) SMN1; SMN2GAATSHRHTTALDH1A1
SCHEMBL3917715 0.88 RAB9A (0.44) SMN1; SMN2GAAALDH1A1PKMMEN1
SCHEMBL3925389 0.88 ACLY (0.35) MMP2MMP13SMN1; SMN2GAATSHR
SCHEMBL3916082 0.86 EPHX2 (0.46) ALDH1A1KDM4EL3MBTL1MEN1KMT2A
SCHEMBL3916725 0.85 KMT2A (0.40) SMN1; SMN2GAATSHRHTTALDH1A1
SCHEMBL3925382 0.85 ALDH1A1 (0.51) MMP2SMN1; SMN2GAATSHRHTT
SCHEMBL3920476 0.85 ALDH1A1 (0.52) SMN1; SMN2TSHRHTTALDH1A1USP2
SCHEMBL3917062 0.84 CHRM5 (0.46) GAAALDH1A1KDM4EUSP2PKM
SCHEMBL3919279 0.84 L3MBTL1 (0.44) MMP13GAATSHRHTTALDH1A1
SCHEMBL3917728 0.84 SMN1; SMN2 (0.39) SMN1; SMN2GAAHTTKDM4EPKM

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7560468-B2 Substituted 1,4,8-triazaspiro[4,5]decan-2-one compounds GRUENENTHAL GMBH (DE) 2009-07-14 US claimed
US-20070015783-A1 Substituted 1,4,8-triazaspiro[4,5]decan-2-one compounds GRUENENTHAL GMBH (DE) 2007-01-18 US claimed
US-7560468-B2 Substituted 1,4,8-triazaspiro[4,5]decan-2-one compounds GRUENENTHAL GMBH (DE) 2009-07-14 US disclosed
US-20070015783-A1 Substituted 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-20070015783-A1 Substituted 1,4,8-triazaspiro[4,5]decan-2-one compounds THPO, UGT1A8, UGT1A4 MMP2 1680/4885MMP13 3451/4885SMN1; SMN2 1274/4885

“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.