SCHEMBL3266982

SCHEMBL3266982

CNC(=O)COC(=O)NCCC1CCN(c2nccc3ccc(Cl)cc23)CC1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SIRT2 Q8IXJ6 5/20 0.45
SIRT1 Q96EB6 4/20 0.45
SIRT3 Q9NTG7 4/20 0.45
FAAH O00519 1/20 0.44
CYP1A2 P05177 1/20 0.39
CYP2D6 P10635 1/20 0.39
MALT1 Q9UDY8 1/20 0.38
CHRM4 P08173 2/20 0.38
NSD2 O96028 2/20 0.37
ENPP2 Q13822 1/20 0.36
KDM4E B2RXH2 1/20 0.36
MAPT P10636 1/20 0.36
TSHR P16473 1/20 0.36
ALOX12 P18054 1/20 0.36
HSD17B10 Q99714 1/20 0.36
HDAC3 O15379 1/20 0.36
HDAC1 Q13547 1/20 0.36
HDAC6 Q9UBN7 1/20 0.36
CXCR3 P49682 1/20 0.36
MAOA P21397 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
SCHEMBL3266170 0.93 SIRT2 (0.45) SIRT2SIRT1SIRT3FAAHCYP1A2
SCHEMBL3266987 0.89 ENPP1 (0.45) SIRT2SIRT1SIRT3MALT1CHRM4
SCHEMBL3268994 0.87 SIRT2 (0.46) SIRT2SIRT1SIRT3FAAHMALT1
SCHEMBL3266166 0.84 SIRT2 (0.45) SIRT2SIRT1SIRT3FAAHCHRM4
SCHEMBL3269114 0.83 SIRT2 (0.45) SIRT2SIRT1SIRT3MALT1CHRM4
SCHEMBL1730265 0.83 SIRT2 (0.50) SIRT2SIRT1SIRT3CYP1A2CYP2D6
SCHEMBL3266255 0.82 FAAH (0.44) FAAHCHRM4ENPP2MAOAMAOB
SCHEMBL241153 0.82 DRD2 (0.45) SIRT2SIRT1SIRT3FAAHMALT1
SCHEMBL3268730 0.82 FAAH (0.46) FAAHCHRM4
Hydrochloric Acid SCHEMBL241075 0.81 DRD2 (0.44) SIRT2SIRT1SIRT3FAAHMALT1

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 SIRT2 268/4885SIRT1 987/4885SIRT3 258/4885

“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.