SCHEMBL8287824

SCHEMBL8287824

CCOC(=O)CCCN1CCC(CNC(=O)c2c3n(c4ccccc24)CCCO3)CC1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
HTR4 Q13639 18/20 1.00
CHRM2 P08172 1/20 0.81
ADRA2B P18089 1/20 0.81
HRH2 P25021 1/20 0.81
HTR1D P28221 1/20 0.81
HTR2A P28223 1/20 0.81
HRH1 P35367 1/20 0.81
HTR2B P41595 1/20 0.81
HTR3A P46098 1/20 0.81
SIGMAR1 Q99720 1/20 0.81

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
SCHEMBL13036123 0.90 HTR4 (0.81) HTR4CHRM2ADRA2BHRH2HTR1D
SCHEMBL8287825 0.89 HTR4 (1.00) HTR4CHRM2ADRA2BHRH2HTR1D
Piboserod SCHEMBL467339 0.89 HTR4 (1.00) HTR4CHRM2ADRA2BHRH2HTR1D
Piboserod SCHEMBL30234609 0.89 HTR4 (1.00) HTR4CHRM2ADRA2BHRH2HTR1D
SCHEMBL8286732 0.88 HTR4 (1.00) HTR4CHRM2ADRA2BHRH2HTR1D
Piboserod SCHEMBL2228911 0.88 HTR4 (0.98) HTR4CHRM2ADRA2BHRH2HTR1D
SCHEMBL7333331 0.85 HTR4 (0.82) HTR4CHRM2ADRA2BHRH2HTR1D
SCHEMBL8286437 0.84 HTR4 (1.00) HTR4CHRM2ADRA2BHRH2HTR1D
SCHEMBL13479924 0.84 HTR4 (0.88) HTR4CHRM2ADRA2BHRH2HTR1D
SCHEMBL7365338 0.84 HTR4 (0.82) HTR4CHRM2ADRA2BHRH2HTR1D

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7834010-B2 Modulators of peripheral 5-HT receptors SERODUS AS (NO) 2010-11-16 US disclosed
US-7834010-B2 Modulators of peripheral 5-HT receptors SERODUS AS (NO) 2010-11-16 US disclosed
US-20090029979-A1 5-HTX MODULATORS BIO-MEDISINSK INNOVASJON AS (NO) 2009-01-29 US disclosed
US-20090029979-A1 5-HTX MODULATORS BIO-MEDISINSK INNOVASJON AS (NO) 2009-01-29 US disclosed
US-20070254874-A1 Modulators of Preripheral 5-Ht Receptors BIO-MEDISINSK INNOVASJON (NO) 2007-11-01 US disclosed
US-20070254874-A1 Modulators of Preripheral 5-Ht Receptors BIO-MEDISINSK INNOVASJON (NO) 2007-11-01 US disclosed
WO-2005061483-A2 MODULATORS OF PERIPHERAL 5-HT RECEPTORS BIO-MEDISINSK INNOVASJON AS (NO) 2005-07-07 WO 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 (2 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-20090029979-A1 5-HTX MODULATORS HTR7, HTR5A, HTR2C HTR4 9/4885CHRM2 293/4885ADRA2B 62/4885
US-20070254874-A1 Modulators of Preripheral 5-Ht Receptors HTR4, HTR5A, HTR6 HTR4 1/4885CHRM2 163/4885ADRA2B 351/4885

“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.