SCHEMBL3265477

SCHEMBL3265477

COc1ccc2nc(N3CCC(CCNC(=O)OCC(N)=O)CC3)ccc2c1

nearest known ligand 0.49

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 1/20 0.49
ACHE P22303 3/20 0.45
BCHE P06276 2/20 0.44
CHRM4 P08173 3/20 0.43
ENPP1 P22413 1/20 0.43
ACACB O00763 3/20 0.42
SUV39H2 Q9H5I1 2/20 0.40
ACACA Q13085 2/20 0.39
SIRT2 Q8IXJ6 1/20 0.39
SIRT1 Q96EB6 1/20 0.39
SIRT3 Q9NTG7 1/20 0.39
KMT2A Q03164 1/20 0.38
KDM4E B2RXH2 1/20 0.38
NPC1 O15118 1/20 0.38
RAB9A P51151 1/20 0.38
KCNH2 Q12809 1/20 0.38

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
SCHEMBL3269870 0.90 HRH3 (0.48) HRH3ACHEBCHECHRM4ENPP1
SCHEMBL3266792 0.90 HRH3 (0.48) HRH3ACHEBCHECHRM4ENPP1
SCHEMBL3266113 0.89 HRH3 (0.47) HRH3ACHEBCHECHRM4ENPP1
SCHEMBL239896 0.87 HRH3 (0.46) HRH3CHRM4ACACBSUV39H2ACACA
SCHEMBL1729968 0.86 HRH3 (0.58) HRH3ACHEBCHECHRM4ENPP1
SCHEMBL240267 0.85 PDE10A (0.44) HRH3ACACBACACAKDM4EKCNH2
SCHEMBL3268726 0.83 HRH3 (0.45) HRH3CHRM4ACACBSUV39H2ACACA
SCHEMBL3265661 0.81 SIRT2 (0.49) ACHEBCHECHRM4ENPP1SIRT2
SCHEMBL3268724 0.79 FAAH (0.45) HRH3CHRM4ACACBSUV39H2ACACA
SCHEMBL1729217 0.78 HRH3 (0.51) HRH3ACHEBCHECHRM4ENPP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120004207-A1 THERAPEUTIC USES OF DERIVATIVES OF PIPERIDINYL-AND PIPERIDINYL-ALKYL CARBAMATES SANOFI-AVENTIS (FR) 2012-01-05 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-20120004207-A1 THERAPEUTIC USES OF DERIVATIVES OF PIPERIDINYL-AND PIPERIDINYL-ALKYL CARBAMATES CLCN2, CLIC1, H4C1; H4C2; H4C3; H4C4; H4C5; H4C6; H4C8; H4C9; H4C11; H4C12; H4C13; H4C14; H4C15; H4C16 HRH3 33/4885ACHE 401/4885BCHE 590/4885

“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.