SCHEMBL16769759

SCHEMBL16769759

CNC(=O)CCC1CN(C)CCO1

nearest known ligand 0.45

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ACKR3 P25106 2/20 0.45
WNT1 P04628 1/20 0.35
GSK3B P49841 1/20 0.35
DYRK1A Q13627 1/20 0.35
SLC6A2 P23975 1/20 0.34
CYP11B2 P19099 1/20 0.33
HRH3 Q9Y5N1 1/20 0.33
ALDH1A1 P00352 1/20 0.33
LMNA P02545 1/20 0.32
PDK1 Q15118 1/20 0.31
MAPK1 P28482 1/20 0.31
IRAK4 Q9NWZ3 1/20 0.31
IL1B P01584 1/20 0.31
P2RX7 Q99572 1/20 0.31
USP2 O75604 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30
TSHR P16473 1/20 0.30

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
SCHEMBL13887585 0.82 ACKR3 (0.39) ACKR3WNT1GSK3BDYRK1ASLC6A2
SCHEMBL16775646 0.82 ACKR3 (0.39) ACKR3WNT1GSK3BDYRK1ASLC6A2
SCHEMBL16769870 0.82 ACKR3 (0.39) ACKR3WNT1GSK3BDYRK1ASLC6A2
SCHEMBL17485483 0.82 ACKR3 (0.39) ACKR3WNT1GSK3BDYRK1ASLC6A2
SCHEMBL16769761 0.81 ACKR3 (0.40) ACKR3WNT1GSK3BDYRK1ASLC6A2
SCHEMBL16769978 0.81 ACKR3 (0.39) ACKR3WNT1GSK3BDYRK1ASLC6A2
SCHEMBL9935790 0.77 HRH3 (0.41) ACKR3SLC6A2HRH3PDK1
SCHEMBL16083808 0.75 ACKR3 (0.47) ACKR3SLC6A2CYP11B2MAPK1IL1B
SCHEMBL23710143 0.75 HRH3 (0.36) ACKR3SLC6A2HRH3
SCHEMBL23710160 0.75 HRH3 (0.36) ACKR3SLC6A2HRH3

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9340538-B2 Dihydropyrimidine compounds and their application in pharmaceuticals SUNSHINE LAKE PHARMA CO., LTD. (CN) 2016-05-17 US disclosed
US-20150152096-A1 DIHYDROPYRIMIDINE COMPOUNDS AND THEIR APPLICATION IN PHARMACEUTICALS SUNSHINE LAKE PHARMA CO., LTD. (CN) 2015-06-04 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-20150152096-A1 DIHYDROPYRIMIDINE COMPOUNDS AND THEIR APPLICATION IN PHARMACEUTICALS DPYD, SLC10A1, HPRT1 ACKR3 1897/4885WNT1 315/4885GSK3B 295/4885

“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.