SCHEMBL3265672

SCHEMBL3265672

NC(=O)COC(=O)NCCC1CCN(c2ncccc2-c2ccccc2)CC1

nearest known ligand 0.45

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CHRM4 P08173 5/20 0.45
NSD2 O96028 4/20 0.42
SIRT2 Q8IXJ6 2/20 0.42
SIRT1 Q96EB6 2/20 0.42
SIRT3 Q9NTG7 2/20 0.42
HTR1A P08908 2/20 0.41
DRD2 P14416 2/20 0.41
HTR7 P34969 2/20 0.41
HTR6 P50406 2/20 0.41
P2RX7 Q99572 1/20 0.41
LRRK2 Q5S007 1/20 0.40
RBP4 P02753 1/20 0.39
TTR P02766 1/20 0.39
CHRM3 P20309 2/20 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
SCHEMBL3269154 0.92 HTR1A (0.43) CHRM4NSD2SIRT2SIRT1SIRT3
SCHEMBL3265694 0.90 P2RX7 (0.47) HTR1ADRD2HTR7HTR6P2RX7
SCHEMBL3266163 0.85 SIRT2 (0.44) CHRM4NSD2SIRT2SIRT1SIRT3
SCHEMBL3269140 0.85 KDM4E (0.57) CHRM4SIRT2SIRT1SIRT3DRD2
SCHEMBL1730153 0.85 CHRM4 (0.52) CHRM4NSD2SIRT2SIRT1SIRT3
SCHEMBL3269143 0.84 CKS1B (0.42) HTR1ADRD2HTR7HTR6P2RX7
SCHEMBL3270079 0.83 SIRT2 (0.49) CHRM4SIRT2SIRT1SIRT3DRD2
SCHEMBL3269145 0.82 P2RX7 (0.46) HTR1ADRD2HTR7HTR6P2RX7
SCHEMBL3265698 0.81 CHRM4 (0.48) CHRM4SIRT2SIRT1SIRT3CHRM3
SCHEMBL3265609 0.78 CKS1B (0.41) CHRM4

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 243/4885NSD2 1884/4885SIRT2 268/4885

“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.