SCHEMBL4928175

SCHEMBL4928175

COCCN(C(=O)c1ccc(N2CCC3(CC2)CCN(C2CCC2)CC3)nc1)C(C)C

nearest known ligand 0.45

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 14/20 0.45
RAB9A P51151 1/20 0.42
ADRA1A P35348 2/20 0.42
NAMPT P43490 1/20 0.39
HSD17B10 Q99714 1/20 0.38
HTR1A P08908 1/20 0.37

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
SCHEMBL4142655 0.89 HRH3 (0.45) HRH3ADRA1AHSD17B10
SCHEMBL4131549 0.86 NAMPT (0.44) HRH3NAMPT
SCHEMBL4130864 0.84 HRH3 (0.47) HRH3ADRA1A
SCHEMBL3768272 0.84 HRH3 (0.48) HRH3RAB9AADRA1ANAMPTHTR1A
SCHEMBL4137012 0.82 HRH3 (0.55) HRH3RAB9AADRA1A
SCHEMBL4138981 0.79 HRH3 (0.46) HRH3RAB9AADRA1A
SCHEMBL4936546 0.78 HRH3 (0.64) HRH3ADRA1AHSD17B10
SCHEMBL4128181 0.78 HRH3 (0.47) HRH3ADRA1AHSD17B10
SCHEMBL4125540 0.78 HRH3 (0.47) HRH3RAB9AADRA1A
SCHEMBL4134776 0.78 SLC6A9 (0.50) HRH3ADRA1AHSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080247964-A1 SUBSTITUTED AZASPIRO DERIVATIVES NEUROGEN CORPORATION 2008-10-09 US claimed
US-20080247964-A1 SUBSTITUTED AZASPIRO DERIVATIVES NEUROGEN CORPORATION 2008-10-09 US disclosed
US-20080247964-A1 SUBSTITUTED AZASPIRO DERIVATIVES NEUROGEN CORPORATION 2008-10-09 US disclosed
US-20080247964-A1 SUBSTITUTED AZASPIRO DERIVATIVES NEUROGEN CORPORATION 2008-10-09 US disclosed
WO-2007133561-A2 SUBSTITUTED AZASPIRO DERIVATIVES NEUROGEN CORPORATION (US) 2007-11-22 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 (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-20080247964-A1 SUBSTITUTED AZASPIRO DERIVATIVES HRH3, HRH4, HRH1 HRH3 1/4885RAB9A 2320/4885ADRA1A 420/4885

“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.