SCHEMBL3925923

SCHEMBL3925923

Cc1cc(C)c(S(=O)(=O)N2CCC3(CC2)NCC(=O)N3Cc2ccc(C(=O)O)c(C)c2)c(C)c1

nearest known ligand 0.40

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.40
MAPT P10636 2/20 0.40
NPSR1 Q6W5P4 2/20 0.40
EPHX2 P34913 4/20 0.39
KMT2A Q03164 4/20 0.39
MEN1 O00255 3/20 0.39
MAPK1 P28482 1/20 0.39
KDM4E B2RXH2 1/20 0.38
NEK2 P51955 1/20 0.38
EBP Q15125 1/20 0.38
DHCR7 Q9UBM7 1/20 0.38
NPC1 O15118 1/20 0.38
LMNA P02545 1/20 0.37
CCR5 P51681 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36

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
SCHEMBL3916099 0.85 POLB (0.45) ALDH1A1MAPTNPSR1EPHX2KMT2A
SCHEMBL3916416 0.80 KEAP1 (0.43) ALDH1A1NPSR1EPHX2KMT2AMEN1
SCHEMBL3920891 0.69 LMNA (0.44) ALDH1A1MAPTKMT2AMEN1KDM4E
SCHEMBL3927361 0.68 MMP2 (0.44) ALDH1A1EPHX2KMT2AMEN1NPC1
SCHEMBL12662898 0.68 CYP2D6 (0.41) ALDH1A1MAPTKMT2AMEN1
SCHEMBL3917508 0.67 EBP (0.47) ALDH1A1MAPTNPSR1EPHX2NEK2
SCHEMBL12662897 0.67 CYP2D6 (0.48) ALDH1A1KMT2AMEN1MAPK1KDM4E
SCHEMBL4038204 0.66 EPHX2 (0.47) ALDH1A1EPHX2KMT2AMEN1MAPK1
SCHEMBL4038092 0.65 ALDH1A1 (0.46) ALDH1A1MAPTNPSR1KMT2AMEN1
SCHEMBL3925460 0.65 ALDH1A1 (0.47) ALDH1A1NPSR1KMT2AMEN1KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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 ALDH1A1 199/4885MAPT 689/4885NPSR1 1350/4885

“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.