SCHEMBL3265696

SCHEMBL3265696

CNC(=O)COC(=O)NC1CCN(c2nccc3ccccc23)CC1

nearest known ligand 0.46

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MALT1 Q9UDY8 1/20 0.46
HRH4 Q9H3N8 1/20 0.46
PDE10A Q9Y233 3/20 0.43
HTR2C P28335 1/20 0.43
DRD2 P14416 4/20 0.43
DRD3 P35462 2/20 0.43
DRD4 P21917 2/20 0.43
SORD Q00796 2/20 0.42
EPHX1 P07099 1/20 0.42
HCAR2 Q8TDS4 1/20 0.42
HTR1A P08908 2/20 0.41
HTR2A P28223 2/20 0.41
PAK1 Q13153 1/20 0.41
ALDH1A1 P00352 1/20 0.41
ACACB O00763 1/20 0.40
CNR1 P21554 1/20 0.40
CNR2 P34972 1/20 0.40

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
SCHEMBL3265718 0.87 MALT1 (0.45) MALT1HRH4HTR2CDRD2DRD4
SCHEMBL27649227 0.86 HRH4 (0.47) MALT1HRH4PDE10AHTR2CDRD2
SCHEMBL3268994 0.85 SIRT2 (0.46) MALT1HRH4HTR2CDRD2DRD4
SCHEMBL2757425 0.84 MALT1 (0.43) MALT1HRH4HTR2CDRD2DRD4
SCHEMBL241153 0.84 DRD2 (0.45) MALT1HRH4HTR2CDRD2DRD4
Hydrochloric Acid SCHEMBL241075 0.83 DRD2 (0.44) MALT1HRH4HTR2CDRD2DRD4
SCHEMBL1729150 0.76 HRH4 (0.48) MALT1HRH4HTR2CDRD2DRD3
SCHEMBL239313 0.74 HRH4 (0.46) MALT1HRH4HTR2CDRD2DRD4
SCHEMBL27649155 0.74 PDE10A (0.45) PDE10ADRD2DRD3HTR1AHTR2A
SCHEMBL3268996 0.74 GSK3B (0.42) MALT1DRD2DRD3DRD4ALDH1A1

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 MALT1 1283/4885HRH4 72/4885PDE10A 1290/4885

“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.