SCHEMBL3268724

SCHEMBL3268724

CNC(=O)COC(=O)NCCC1CCN(c2ccc3cc(Cl)ccc3n2)CC1

nearest known ligand 0.45

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
FAAH O00519 1/20 0.45
HRH3 Q9Y5N1 2/20 0.44
HTR3A P46098 2/20 0.44
HRH4 Q9H3N8 1/20 0.44
PDE10A Q9Y233 2/20 0.43
MCHR1 Q99705 2/20 0.43
MAP4K4 O95819 1/20 0.41
SUV39H2 Q9H5I1 2/20 0.40
ACACB O00763 3/20 0.40
SCD O00767 2/20 0.39
ACACA Q13085 2/20 0.39
KCNH2 Q12809 1/20 0.38
PDE2A O00408 1/20 0.38
CHRM4 P08173 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
SCHEMBL3268730 0.94 FAAH (0.46) FAAHHRH3HTR3AHRH4PDE10A
SCHEMBL10202394 0.91 HRH3 (0.46) FAAHHRH3HTR3AHRH4PDE10A
SCHEMBL239896 0.89 HRH3 (0.46) HRH3HTR3AHRH4PDE10AMCHR1
SCHEMBL3269870 0.89 HRH3 (0.48) HRH3MCHR1MAP4K4SUV39H2ACACB
SCHEMBL241775 0.87 ACACB (0.44) PDE10AMAP4K4ACACBACACAKCNH2
SCHEMBL3266255 0.87 FAAH (0.44) FAAHSUV39H2SCDCHRM4
SCHEMBL345825 0.83 HRH3 (0.39) HRH3HTR3AHRH4PDE10AMCHR1
SCHEMBL239157 0.83 ACACB (0.42) FAAHMAP4K4SUV39H2ACACBACACA
SCHEMBL3265670 0.83 MAP4K4 (0.44) FAAHPDE10AMAP4K4ACACBACACA
SCHEMBL346050 0.83 HRH3 (0.56) HRH3HTR3AHRH4PDE10AMCHR1

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.