SCHEMBL1801504

SCHEMBL1801504

CN(C)c1cccc(C(=O)N2CCC3(CC2)NC(Cc2ccccc2)C(=O)N3Cc2ccccc2)c1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.47
SCN5A Q14524 1/20 0.44
SCN9A Q15858 1/20 0.44
RIPK1 Q13546 1/20 0.42
MAPK1 P28482 2/20 0.42
LMNA P02545 2/20 0.42
CYP2D6 P10635 2/20 0.42
TSHR P16473 3/20 0.42
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
ABL1 P00519 3/20 0.41
BCR P11274 3/20 0.41
HSD11B1 P28845 1/20 0.41
ALDH1A1 P00352 1/20 0.41
CHRM2 P08172 3/20 0.41
CHRM3 P20309 3/20 0.41
CYP3A4 P08684 1/20 0.39
GAA P10253 1/20 0.39

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
SCHEMBL1798944 0.89 MAPT (0.48) MAPTSCN5ASCN9AMAPK1LMNA
SCHEMBL1801286 0.86 ALDH1A1 (0.54) MAPTRIPK1LMNACYP2D6TSHR
Hydrochloric Acid SCHEMBL1804425 0.85 ALDH1A1 (0.53) MAPTRIPK1LMNACYP2D6TSHR
SCHEMBL1807471 0.83 NPC1 (0.54) RIPK1LMNATSHR
Hydrochloric Acid SCHEMBL1811368 0.83 NPC1 (0.53) RIPK1LMNATSHR
SCHEMBL1801302 0.82 RIPK1 (0.47) RIPK1LMNACYP2D6TSHRMEN1
SCHEMBL4000263 0.82 RIPK1 (0.47) RIPK1LMNACYP2D6TSHRMEN1
SCHEMBL2937853 0.82 RIPK1 (0.47) RIPK1LMNACYP2D6TSHRMEN1
Hydrochloric Acid SCHEMBL1800383 0.81 RIPK1 (0.47) RIPK1LMNACYP2D6TSHRMEN1
SCHEMBL1799019 0.81 RIPK1 (0.47) MAPTRIPK1MAPK1LMNACYP2D6

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 6 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
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 claimed
US-7951815-B2 Substituted 1,4,8-triazaspiro [4,5]decan-2-one compounds GRUENENTHAL GMBH (DE) 2011-05-31 US disclosed
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 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 MAPT 2471/4885SCN5A 883/4885SCN9A 1046/4885

“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.