SCHEMBL8286386

SCHEMBL8286386

CCOP(=O)(CCN1CCC(COC(=O)c2cccc3ccccc23)CC1)OCC

nearest known ligand 0.52

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 2/20 0.49
HTR4 Q13639 3/20 0.48
CARM1 Q86X55 1/20 0.47
PRMT6 Q96LA8 1/20 0.47
CYP1A2 P05177 1/20 0.45
CYP2C9 P11712 1/20 0.45
ALOX15 P16050 1/20 0.45
NFKB1 P19838 1/20 0.45
PMP22 Q01453 1/20 0.45
NPSR1 Q6W5P4 1/20 0.45
CHRNB2 P17787 2/20 0.45
CHRNB4 P30926 2/20 0.45
CHRNA3 P32297 2/20 0.45
CHRNA4 P43681 2/20 0.45
DRD3 P35462 1/20 0.45
DRD2 P14416 1/20 0.44
DRD4 P21917 1/20 0.44
CDC25B P30305 1/20 0.43

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
SCHEMBL13479856 0.91 HRH3 (0.48) HRH3HTR4CARM1PRMT6CYP1A2
SCHEMBL8286387 0.81 HRH3 (0.55) HRH3HTR4CHRNB2CHRNB4CHRNA3
SCHEMBL8287623 0.79 HTR4 (0.70) HRH3HTR4CARM1PRMT6CHRNB2
SCHEMBL8287634 0.77 DRD4 (0.67) CHRNB2CHRNB4CHRNA3CHRNA4DRD2
SCHEMBL2114876 0.77 CDC25B (0.52) HRH3CHRNB2CHRNB4CHRNA3CHRNA4
SCHEMBL13498624 0.77 CDC25B (0.52) HRH3CHRNB2CHRNB4CHRNA3CHRNA4
SCHEMBL27421053 0.73 CHRNB2 (0.50) HRH3CHRNB2CHRNB4CHRNA3CHRNA4
SCHEMBL13036115 0.73 HTR4 (0.52) HRH3HTR4CYP1A2CYP2C9ALOX15
SCHEMBL30534102 0.72 CDC25B (0.48) HRH3CHRNB2CHRNB4CHRNA3CHRNA4
SCHEMBL8287645 0.71 CHRM2 (0.48) HRH3CHRNB2CHRNB4CHRNA3CHRNA4

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 8 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-2007007072-A1 5-HTX MODULATORS BIO-MEDISINSK INNOVASJON AS (NO) 2007-01-18 WO 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 HRH3 364/4885HTR4 9/4885CARM1 4515/4885
US-20070254874-A1 Modulators of Preripheral 5-Ht Receptors HTR4, HTR5A, HTR6 HRH3 80/4885HTR4 1/4885CARM1 3019/4885

“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.