SCHEMBL1801220

SCHEMBL1801220

CCC(C(=O)O)N1C(=O)C(Cc2ccccc2)NC12CCN(C(=O)c1cc(OC)c(OC)c(OC)c1)CC2

nearest known ligand 0.48

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.48
CYP1A2 P05177 1/20 0.48
SMN1; SMN2 Q16637 1/20 0.44
MEN1 O00255 3/20 0.42
KMT2A Q03164 3/20 0.42
L3MBTL1 Q9Y468 1/20 0.41
KDM4E B2RXH2 1/20 0.41
GAA P10253 1/20 0.40
CDK5 Q00535 1/20 0.40
CDK5R1 Q15078 1/20 0.40
TP53 P04637 1/20 0.40
HSD17B10 Q99714 1/20 0.40

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
SCHEMBL1800768 0.85 KMT2A (0.43) ALDH1A1SMN1; SMN2MEN1KMT2AKDM4E
SCHEMBL2943558 0.84 ALDH1A1 (0.50) ALDH1A1CYP1A2SMN1; SMN2MEN1KMT2A
SCHEMBL1807036 0.83 NPC1 (0.46)
SCHEMBL1801910 0.83 KMT2A (0.44) ALDH1A1SMN1; SMN2MEN1KMT2AGAA
SCHEMBL1800448 0.81 KMT2A (0.40) MEN1KMT2A
SCHEMBL1800404 0.81 CA1 (0.52)
SCHEMBL1801112 0.81 CRBN (0.45) SMN1; SMN2KMT2A
SCHEMBL1798648 0.81 MGLL (0.42) ALDH1A1SMN1; SMN2MEN1KMT2AL3MBTL1
SCHEMBL1801813 0.81 CYP2C9 (0.49) ALDH1A1SMN1; SMN2MEN1KMT2AKDM4E
SCHEMBL1802355 0.81 CYP3A4 (0.55) ALDH1A1SMN1; SMN2GAA

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-7951815-B2 Substituted 1,4,8-triazaspiro [4,5]decan-2-one compounds GRUENENTHAL GMBH (DE) 2011-05-31 US claimed
US-20070015784-A1 Subsitituted 1,4,8- triazaspiro [4,5]decan-2-one compounds GRUENENTHAL GMBH (DE) 2007-01-18 US claimed
US-7951815-B2 Substituted 1,4,8-triazaspiro [4,5]decan-2-one compounds GRUENENTHAL GMBH (DE) 2011-05-31 US disclosed
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 ALDH1A1 2780/4885CYP1A2 817/4885SMN1; SMN2 2139/4885

“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.