SCHEMBL3917062

SCHEMBL3917062

CCC(C(=O)O)N1C(=O)C(Cc2ccccc2)NC12CCN(S(=O)(=O)c1ccc(OC)cc1)CC2

nearest known ligand 0.46

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CHRM5 P08912 2/20 0.46
LMNA P02545 1/20 0.46
PKM P14618 3/20 0.45
MEN1 O00255 3/20 0.45
KMT2A Q03164 3/20 0.45
ALDH1A1 P00352 3/20 0.44
HSD11B1 P28845 1/20 0.44
KDM4E B2RXH2 1/20 0.44
GAA P10253 1/20 0.42
CYP3A4 P08684 2/20 0.42
USP2 O75604 1/20 0.42
CYP1A2 P05177 1/20 0.42
CYP2D6 P10635 1/20 0.42
NR3C1 P04150 1/20 0.42

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 0.92 CYP2D6 (0.42) CHRM5LMNAPKMMEN1KMT2A
SCHEMBL3919279 0.91 L3MBTL1 (0.44) LMNAPKMMEN1KMT2AALDH1A1
SCHEMBL3920476 0.90 ALDH1A1 (0.52) LMNAMEN1KMT2AALDH1A1CYP3A4
SCHEMBL3916725 0.89 KMT2A (0.40) LMNAMEN1KMT2AALDH1A1HSD11B1
SCHEMBL3925382 0.85 ALDH1A1 (0.51) CHRM5LMNAMEN1KMT2AALDH1A1
SCHEMBL3927490 0.85 MEN1 (0.43) LMNAMEN1KMT2AALDH1A1KDM4E
SCHEMBL3925468 0.84 MMP2 (0.37) LMNAPKMMEN1KMT2AALDH1A1
SCHEMBL1803052 0.84 SMN1; SMN2 (0.46) LMNAMEN1KMT2AALDH1A1KDM4E
SCHEMBL4035567 0.83 LMNA (0.48) CHRM5LMNAPKMMEN1KMT2A
SCHEMBL3916082 0.83 EPHX2 (0.46) MEN1KMT2AALDH1A1KDM4ECYP3A4

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 CHRM5 3785/4885LMNA 1640/4885PKM 1588/4885

“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.