SCHEMBL3265663

SCHEMBL3265663

NC(=O)COC(=O)NCCC1CCN(c2cc3ccccc3cn2)CC1

nearest known ligand 0.44

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CHRM4 P08173 11/20 0.44
HTR3A P46098 1/20 0.40
CKS1B P61024 1/20 0.40
SKP1 P63208 1/20 0.40
SKP2 Q13309 1/20 0.40
SIRT2 Q8IXJ6 2/20 0.40
SIRT1 Q96EB6 2/20 0.40
SIRT3 Q9NTG7 2/20 0.40
CHRM2 P08172 3/20 0.39
CHRM1 P11229 1/20 0.39
TPSAB1 Q15661 1/20 0.39
TPSD1 Q9BZJ3 1/20 0.39
TPSG1 Q9NRR2 1/20 0.39

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
SCHEMBL239096 0.89 CHRM4 (0.45) CHRM4HTR3ACKS1BSKP1SKP2
SCHEMBL3265727 0.84 HCAR2 (0.45) CHRM4HTR3ACKS1BSKP1SKP2
SCHEMBL3270238 0.83 CHRM4 (0.51) CHRM4HTR3ASIRT2SIRT1SIRT3
SCHEMBL1728734 0.83 CHRM4 (0.51) CHRM4HTR3ACKS1BSKP1SKP2
SCHEMBL240267 0.83 PDE10A (0.44) HTR3A
SCHEMBL3265698 0.83 CHRM4 (0.48) CHRM4CKS1BSKP1SKP2SIRT2
SCHEMBL3266256 0.82 DEGS1 (0.48) CHRM4CHRM2CHRM1
SCHEMBL3269077 0.82 CHRM4 (0.49) CHRM4SIRT2SIRT1SIRT3CHRM2
SCHEMBL3266210 0.82 CHRM4 (0.45) CHRM4SIRT2SIRT1SIRT3CHRM2
SCHEMBL3265639 0.80 HRH3 (0.44) CHRM4SIRT2SIRT1SIRT3

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 CHRM4 243/4885HTR3A 2303/4885CKS1B 1534/4885

“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.