SCHEMBL3265694

SCHEMBL3265694

NC(=O)COC(=O)NCC1CCN(c2ncccc2-c2ccccc2)CC1

nearest known ligand 0.47

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
P2RX7 Q99572 1/20 0.47
CKS1B P61024 9/20 0.44
SKP1 P63208 9/20 0.44
SKP2 Q13309 9/20 0.44
LRRK2 Q5S007 1/20 0.41
HTR7 P34969 3/20 0.41
HTR1A P08908 2/20 0.41
DRD2 P14416 2/20 0.41
HTR6 P50406 2/20 0.41
CHRM3 P20309 2/20 0.40
LDHA P00338 1/20 0.39
FAAH O00519 1/20 0.39
BCHE P06276 1/20 0.39
ACHE P22303 1/20 0.39
HIF1A Q16665 1/20 0.39
KDM4E B2RXH2 1/20 0.39
RECQL P46063 1/20 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
SCHEMBL3269145 0.92 P2RX7 (0.46) P2RX7CKS1BSKP1SKP2HTR7
SCHEMBL3265672 0.90 CHRM4 (0.45) P2RX7LRRK2HTR7HTR1ADRD2
SCHEMBL3269143 0.86 CKS1B (0.42) P2RX7CKS1BSKP1SKP2HTR7
SCHEMBL3270076 0.85 MALT1 (0.42) P2RX7CKS1BSKP1SKP2LDHA
SCHEMBL3267012 0.84 KDM4E (0.59) DRD2LDHAKDM4ERECQL
SCHEMBL1727773 0.84 P2RX7 (0.54) P2RX7CKS1BSKP1SKP2LRRK2
SCHEMBL3269154 0.82 HTR1A (0.43) P2RX7HTR7HTR1ADRD2HTR6
SCHEMBL3269965 0.80 DKK1 (0.57) CKS1BSKP1SKP2
SCHEMBL3265642 0.79 CKS1B (0.51) CKS1BSKP1SKP2FAAHBCHE
SCHEMBL3268917 0.78 CKS1B (0.47) CKS1BSKP1SKP2RECQL

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 P2RX7 1286/4885CKS1B 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.