SCHEMBL240288

SCHEMBL240288

CS(=O)(=O)OCCC1CCN(c2nccc3cc(F)ccc23)CC1

nearest known ligand 0.38

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
GPR6 P46095 3/20 0.38
ENPP1 P22413 5/20 0.38
PDE10A Q9Y233 2/20 0.38
KCNH2 Q12809 2/20 0.38
SIRT2 Q8IXJ6 1/20 0.37
SIRT1 Q96EB6 1/20 0.37
SIRT3 Q9NTG7 1/20 0.37
HTR2A P28223 3/20 0.36
DRD2 P14416 3/20 0.36
DRD3 P35462 2/20 0.36
HTR2C P28335 1/20 0.36
CYP1A2 P05177 1/20 0.35
CYP2D6 P10635 1/20 0.35
GRM4 Q14833 1/20 0.35
HSD11B1 P28845 1/20 0.35
HTR1A P08908 1/20 0.35
HTR7 P34969 1/20 0.35
HTR6 P50406 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
SCHEMBL239086 0.80 PDE10A (0.47) GPR6PDE10AKCNH2SIRT2SIRT1
SCHEMBL1727950 0.76 SIRT2 (0.50) GPR6PDE10ASIRT2SIRT1SIRT3
SCHEMBL17847566 0.74 HTR6 (0.37) GPR6PDE10ADRD2HTR1AHTR7
SCHEMBL17847564 0.74 HTR6 (0.37) GPR6PDE10ADRD2HTR1AHTR7
SCHEMBL1728989 0.73 SIRT2 (0.40) GPR6PDE10ASIRT2SIRT1SIRT3
SCHEMBL1729857 0.73 GPR6 (0.39) GPR6PDE10ASIRT2SIRT1SIRT3
SCHEMBL27649157 0.73 DPP4 (0.39) GPR6PDE10AKCNH2DRD2DRD3
SCHEMBL238634 0.73 CHRM5 (0.40) PDE10AKCNH2HTR2ADRD2DRD3
SCHEMBL3266166 0.73 SIRT2 (0.45) GPR6ENPP1PDE10ASIRT2SIRT1
SCHEMBL238082 0.72 SIRT2 (0.49) GPR6ENPP1SIRT2SIRT1SIRT3

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 5 patents. 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
US-8034818-B2 Therapeutic uses of derivatives of piperidinyl- and piperazinyl-alkyl carbamates SANOFI-AVENTIS (FR) 2011-10-11 US disclosed
US-20070142350-A1 THERAPEUTIC USES OF DERIVATIVES OF PIPERIDINYL- AND PIPERAZINYL-ALKYL CARBAMATES SANOFI-AVENTIS (FR) 2007-06-21 US disclosed
US-7214798-B2 Derivatives of piperidinyl-and piperazinyl-alkyl carbamates, preparation methods thereof and application of same in therapeutics SANOFI-AVENTIS (FR) 2007-05-08 US disclosed
US-20060089344-A1 Derivatives of piperidinyl-and piperazinyl-alkyl carbamates, preparation methods thereof and application of same in therapeutics SANOFI-AVENTIS (FR) 2006-04-27 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 (3 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-20060089344-A1 Derivatives of piperidinyl-and piperazinyl-alkyl carbamates, preparation methods thereof and application of same in therapeutics CLCN2, CNR2, RCC2 GPR6 768/4885ENPP1 1963/4885PDE10A 944/4885
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 GPR6 1559/4885ENPP1 1666/4885PDE10A 1290/4885
US-20070142350-A1 THERAPEUTIC USES OF DERIVATIVES OF PIPERIDINYL- AND PIPERAZINYL-ALKYL CARBAMATES H4C1; H4C2; H4C3; H4C4; H4C5; H4C6; H4C8; H4C9; H4C11; H4C12; H4C13; H4C14; H4C15; H4C16, CBR3, H1-2 GPR6 1229/4885ENPP1 1231/4885PDE10A 1481/4885

“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.