SCHEMBL2851722

SCHEMBL2851722

CS(=O)(=O)N1CCC2(CC1)CC(C(=O)N1CCN(C3CCCC3)CC1)C2

nearest known ligand 0.95

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 15/20 0.95
KCNH2 Q12809 1/20 0.49
ALDH1A1 P00352 2/20 0.45
TSHR P16473 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
KDM4E B2RXH2 1/20 0.45
ACACB O00763 1/20 0.44
ACACA Q13085 1/20 0.44

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
SCHEMBL2841330 0.97 HRH3 (1.00) HRH3KCNH2ALDH1A1TSHRSMN1; SMN2
SCHEMBL2843195 0.85 HRH3 (0.78) HRH3KCNH2ALDH1A1
SCHEMBL2845239 0.82 HRH3 (0.74) HRH3KCNH2ALDH1A1TSHR
SCHEMBL2844050 0.80 HRH3 (0.67) HRH3TSHRSMN1; SMN2
SCHEMBL13299854 0.80 HRH3 (0.66) HRH3ALDH1A1TSHRSMN1; SMN2
SCHEMBL2850390 0.79 HRH3 (0.69) HRH3ALDH1A1TSHRSMN1; SMN2
SCHEMBL2850391 0.79 HRH3 (0.69) HRH3ALDH1A1TSHRSMN1; SMN2
SCHEMBL2842450 0.79 HRH3 (0.69) HRH3ALDH1A1TSHRKDM4E
SCHEMBL2842453 0.79 HRH3 (0.69) HRH3ALDH1A1TSHRKDM4E
SCHEMBL2850253 0.79 HRH3 (0.69) HRH3ALDH1A1TSHRKDM4E

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
WO-2010062245-A1 SPIROCYCLOBUTYL PIPERIDINE DERIVATIVES ASTRAZENECA AB (SE) 2010-06-03 WO claimed
US-20100130477-A1 Spirocyclobutyl Piperidine Derivatives ASTRAZENECA AB (SE) 2010-05-27 US claimed
WO-2010062245-A1 SPIROCYCLOBUTYL PIPERIDINE DERIVATIVES ASTRAZENECA AB (SE) 2010-06-03 WO disclosed
WO-2010062245-A1 SPIROCYCLOBUTYL PIPERIDINE DERIVATIVES ASTRAZENECA AB (SE) 2010-06-03 WO disclosed
US-20100130477-A1 Spirocyclobutyl Piperidine Derivatives ASTRAZENECA AB (SE) 2010-05-27 US disclosed
US-20100130477-A1 Spirocyclobutyl Piperidine Derivatives ASTRAZENECA AB (SE) 2010-05-27 US disclosed
US-20100130477-A1 Spirocyclobutyl Piperidine Derivatives ASTRAZENECA AB (SE) 2010-05-27 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-20100130477-A1 Spirocyclobutyl Piperidine Derivatives HRH3, HRH4, HRH2 HRH3 1/4885KCNH2 1341/4885ALDH1A1 486/4885

“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.