SCHEMBL3268730

SCHEMBL3268730

CNC(=O)COC(=O)NCCC1CCN(c2ccc3ccc(Cl)cc3n2)CC1

nearest known ligand 0.46

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
FAAH O00519 1/20 0.46
HRH3 Q9Y5N1 2/20 0.43
HTR3A P46098 2/20 0.43
HTR3E A5X5Y0 1/20 0.43
HTR3B O95264 1/20 0.43
HTR3D Q70Z44 1/20 0.43
HTR3C Q8WXA8 1/20 0.43
PDE10A Q9Y233 2/20 0.43
PDE2A O00408 1/20 0.43
SUV39H2 Q9H5I1 2/20 0.41
SCD O00767 2/20 0.40
MAP4K4 O95819 1/20 0.40
MCHR1 Q99705 1/20 0.38
ACACB O00763 2/20 0.38
ACACA Q13085 2/20 0.38
KCNH2 Q12809 1/20 0.37
CHRM4 P08173 2/20 0.37
BACE1 P56817 1/20 0.37
HRH4 Q9H3N8 1/20 0.36

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
SCHEMBL3268724 0.94 FAAH (0.45) FAAHHRH3HTR3APDE10APDE2A
SCHEMBL3268726 0.89 HRH3 (0.45) HRH3HTR3AHTR3EHTR3BHTR3D
SCHEMBL241775 0.88 ACACB (0.44) PDE10APDE2AMAP4K4ACACBACACA
SCHEMBL3266255 0.86 FAAH (0.44) FAAHSUV39H2SCDCHRM4
SCHEMBL10202394 0.84 HRH3 (0.46) FAAHHRH3HTR3APDE10APDE2A
SCHEMBL3269870 0.84 HRH3 (0.48) HRH3SUV39H2MAP4K4MCHR1ACACB
SCHEMBL239157 0.84 ACACB (0.42) FAAHSUV39H2MAP4K4ACACBACACA
SCHEMBL3265480 0.83 PTGES (0.45) FAAHPDE10ASUV39H2MAP4K4CHRM4
SCHEMBL239896 0.83 HRH3 (0.46) HRH3HTR3AHTR3EHTR3BHTR3D
SCHEMBL1728774 0.82 HRH3 (0.55) HRH3HTR3AHTR3EHTR3BHTR3D

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 FAAH 361/4885HRH3 33/4885HTR3A 2303/4885

“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.