SCHEMBL3269965

SCHEMBL3269965

NC(=O)COC(=O)NCC1CCN(c2nccc(-c3ccccc3)n2)CC1

nearest known ligand 0.57

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
DKK1 O94907 3/20 0.57
CKS1B P61024 7/20 0.45
SKP1 P63208 7/20 0.45
SKP2 Q13309 7/20 0.45
HCAR2 Q8TDS4 1/20 0.44
VCP P55072 1/20 0.43
ACACB O00763 1/20 0.42
ACACA Q13085 1/20 0.42
HCRTR1 O43613 3/20 0.41
HCRTR2 O43614 3/20 0.41
SORD Q00796 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
SCHEMBL1729056 0.85 DKK1 (0.66) DKK1CKS1BSKP1SKP2HCAR2
SCHEMBL240063 0.84 CKS1B (0.48) CKS1BSKP1SKP2ACACBACACA
SCHEMBL3265549 0.82 CHRM4 (0.50) DKK1ACACB
SCHEMBL3268917 0.81 CKS1B (0.47) CKS1BSKP1SKP2ACACBACACA
SCHEMBL3265598 0.80 CKS1B (0.46) CKS1BSKP1SKP2
SCHEMBL3265694 0.80 P2RX7 (0.47) CKS1BSKP1SKP2
SCHEMBL3265642 0.78 CKS1B (0.51) CKS1BSKP1SKP2
SCHEMBL3650257 0.77 DKK1 (0.82) DKK1CKS1BSKP1SKP2HCAR2
SCHEMBL2757435 0.77 DPP4 (0.44) DKK1CKS1BSKP1SKP2HCAR2
SCHEMBL3266878 0.76 CKS1B (0.45) DKK1CKS1BSKP1SKP2VCP

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 DKK1 4744/4885CKS1B 1534/4885SKP1 4286/4885

“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.