SCHEMBL3268917

SCHEMBL3268917

NC(=O)COC(=O)NCC1CCN(c2cc(-c3ccccc3)ncn2)CC1

nearest known ligand 0.47

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CKS1B P61024 11/20 0.47
SKP1 P63208 11/20 0.47
SKP2 Q13309 11/20 0.47
NPC1 O15118 1/20 0.46
TSHR P16473 1/20 0.46
RECQL P46063 1/20 0.46
RAB9A P51151 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
HRH4 Q9H3N8 1/20 0.45
ACACB O00763 4/20 0.42
ACACA Q13085 4/20 0.42
DPP4 P27487 2/20 0.41
LOXL2 Q9Y4K0 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
SCHEMBL1729041 0.85 NPC1 (0.55) CKS1BSKP1SKP2NPC1TSHR
SCHEMBL3265598 0.84 CKS1B (0.46) CKS1BSKP1SKP2NPC1RAB9A
SCHEMBL240063 0.84 CKS1B (0.48) CKS1BSKP1SKP2ACACBACACA
SCHEMBL3265642 0.82 CKS1B (0.51) CKS1BSKP1SKP2
SCHEMBL3269965 0.81 DKK1 (0.57) CKS1BSKP1SKP2ACACBACACA
SCHEMBL3266167 0.78 NOS2 (0.38) CKS1BSKP1SKP2
SCHEMBL3265694 0.78 P2RX7 (0.47) CKS1BSKP1SKP2RECQL
SCHEMBL3267178 0.77 CKS1B (0.52) CKS1BSKP1SKP2NPC1RAB9A
SCHEMBL3266878 0.76 CKS1B (0.45) CKS1BSKP1SKP2NPC1RAB9A
SCHEMBL3265698 0.76 CHRM4 (0.48) CKS1BSKP1SKP2

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 CKS1B 1534/4885SKP1 4286/4885SKP2 2651/4885

“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.