SCHEMBL3265668

SCHEMBL3265668

CNC(=O)COC(=O)NCCC1CCN(c2cnc3ccccc3c2)CC1

nearest known ligand 0.51

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CHRM4 P08173 7/20 0.51
DRD3 P35462 2/20 0.45
DRD2 P14416 1/20 0.45
HTR3A P46098 1/20 0.44
HTR2A P28223 1/20 0.43
HTR2C P28335 1/20 0.43
AKR1C3 P42330 1/20 0.42
CHRM2 P08172 1/20 0.41
TRPV1 Q8NER1 1/20 0.41
CHRNB2 P17787 1/20 0.41
CHRNA4 P43681 1/20 0.41
CNR2 P34972 3/20 0.41
HTR7 P34969 1/20 0.40
HTR6 P50406 1/20 0.40
CNR1 P21554 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
SCHEMBL3270238 0.89 CHRM4 (0.51) CHRM4DRD3DRD2HTR3AHTR2A
SCHEMBL3267181 0.86 CKS1B (0.44) CHRM4HTR3A
SCHEMBL239096 0.84 CHRM4 (0.45) CHRM4HTR3A
SCHEMBL241775 0.83 ACACB (0.44) DRD3DRD2
SCHEMBL1729026 0.82 CHRM4 (0.59) CHRM4DRD3DRD2HTR3AHTR2A
SCHEMBL3270574 0.82 CHRM4 (0.44) CHRM4CHRM2
SCHEMBL3268994 0.80 SIRT2 (0.46) CHRM4DRD2HTR2C
SCHEMBL3266796 0.80 CHRM4 (0.48) CHRM4DRD3DRD2
SCHEMBL237971 0.80 CYP11B2 (0.44) CHRM4DRD2HTR2ATRPV1HTR7
SCHEMBL3265695 0.80 SIRT2 (0.45) CHRM4DRD3DRD2HTR2AHTR2C

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 243/4885DRD3 657/4885DRD2 1223/4885

“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.