SCHEMBL4290718

SCHEMBL4290718

CC(=O)c1ccc(N2CCC3(CC2)CCN(C2CCC2)C3)nc1

nearest known ligand 0.60

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 9/20 0.60
ADRA1A P35348 5/20 0.48
MAPT P10636 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
UBE2T Q9NPD8 1/20 0.41
CRBN Q96SW2 2/20 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
SCHEMBL4929417 0.94 HRH3 (0.59) HRH3ADRA1ACRBN
SCHEMBL4936546 0.94 HRH3 (0.64) HRH3ADRA1AMAPTSMN1; SMN2UBE2T
SCHEMBL4136446 0.85 HRH3 (0.54) HRH3ADRA1AMAPTSMN1; SMN2
SCHEMBL4130587 0.83 HRH3 (0.51) HRH3ADRA1AUBE2T
SCHEMBL6117792 0.82 HRH3 (0.66) HRH3ADRA1AMAPTSMN1; SMN2
SCHEMBL14027177 0.82 HRH3 (0.64) HRH3ADRA1AUBE2T
SCHEMBL4130565 0.82 HRH3 (0.52) HRH3ADRA1ASMN1; SMN2
SCHEMBL4433768 0.81 ADRA1A (0.57) HRH3ADRA1A
SCHEMBL4137012 0.80 HRH3 (0.55) HRH3ADRA1ASMN1; SMN2CRBN
SCHEMBL4130774 0.80 ALDH1A1 (0.59) HRH3ADRA1A

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
EP-2021004-A2 SUBSTITUTED AZASPIRO DERIVATIVES NEUROGEN CORPORATION (US) 2009-02-11 EP claimed
US-20080247964-A1 SUBSTITUTED AZASPIRO DERIVATIVES NEUROGEN CORPORATION 2008-10-09 US claimed
WO-2007133561-A2 SUBSTITUTED AZASPIRO DERIVATIVES NEUROGEN CORPORATION (US) 2007-11-22 WO 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 1/4885ADRA1A 420/4885MAPT 1220/4885

“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.