SCHEMBL3265574

SCHEMBL3265574

NC(=O)COC(=O)NCCC1CCN(c2cccc(Br)n2)CC1

nearest known ligand 0.40

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
TPSAB1 Q15661 1/20 0.40
TPSD1 Q9BZJ3 1/20 0.40
TPSG1 Q9NRR2 1/20 0.40
HSD11B1 P28845 2/20 0.40
CHRM4 P08173 6/20 0.39
SUV39H2 Q9H5I1 2/20 0.37
SIRT2 Q8IXJ6 2/20 0.37
SIRT1 Q96EB6 2/20 0.37
SIRT3 Q9NTG7 2/20 0.37
BDKRB1 P46663 1/20 0.37
CHRM2 P08172 1/20 0.36
ACACB O00763 2/20 0.36
ACACA Q13085 2/20 0.36
KCNH2 Q12809 1/20 0.36
PRKCQ Q04759 1/20 0.36
CKS1B P61024 1/20 0.35
SKP1 P63208 1/20 0.35
SKP2 Q13309 1/20 0.35

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
SCHEMBL3266881 0.90 BDKRB1 (0.43) TPSAB1TPSD1TPSG1HSD11B1BDKRB1
SCHEMBL3265609 0.85 CKS1B (0.41) TPSAB1TPSD1TPSG1HSD11B1CHRM4
SCHEMBL3269876 0.84 HRH3 (0.40) TPSAB1TPSD1TPSG1HSD11B1CHRM4
SCHEMBL3268988 0.83 HSD11B1 (0.41) HSD11B1CHRM4CKS1BSKP1SKP2
SCHEMBL240267 0.83 PDE10A (0.44) ACACBACACAKCNH2
SCHEMBL3265618 0.83 CNR1 (0.41) CHRM4CHRM2CKS1BSKP1SKP2
SCHEMBL3270231 0.82 PTGES (0.44) TPSAB1TPSD1TPSG1CHRM4SUV39H2
SCHEMBL3269077 0.82 CHRM4 (0.49) TPSAB1TPSD1TPSG1CHRM4SIRT2
SCHEMBL10202391 0.81 ACACB (0.41) CHRM4SUV39H2ACACBACACAKCNH2
SCHEMBL3265727 0.80 HCAR2 (0.45) TPSAB1TPSD1TPSG1CHRM4ACACB

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 TPSAB1 3455/4885TPSD1 3757/4885TPSG1 3860/4885

“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.