SCHEMBL4170288

SCHEMBL4170288

CCC(=O)CNC(=O)c1cc(Cl)c(N2CCC(C(=O)O)CC2)nc1CN1CCCC1=O

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
P2RX7 Q99572 2/20 0.38
IL1B P01584 1/20 0.35
MPL P40238 6/20 0.34
MAPK1 P28482 2/20 0.34
HSD11B1 P28845 1/20 0.34
TYRO3 Q06418 4/20 0.33
CNR2 P34972 1/20 0.33
RORC P51449 1/20 0.33
KDM4E B2RXH2 1/20 0.33
USP2 O75604 1/20 0.33
HPGD P15428 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
HSD17B10 Q99714 1/20 0.33
CASK O14936 2/20 0.33
ABL1 P00519 1/20 0.33
EGFR P00533 1/20 0.33
NTRK1 P04629 1/20 0.33
MET P08581 1/20 0.33
SELP P16109 1/20 0.33
AXL P30530 1/20 0.33

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
SCHEMBL4180416 0.90 MAPT (0.33) P2RX7IL1BMAPK1TYRO3RORC
SCHEMBL4179572 0.87 P2RX7 (0.37) P2RX7IL1BMPLMAPK1HSD11B1
SCHEMBL3941725 0.83 P2RY12 (0.39) P2RX7MPLMAPK1HSD11B1RORC
SCHEMBL4172553 0.83 NOTUM (0.36) P2RX7MPLRORCKDM4EUSP2
SCHEMBL4742022 0.82 OPRK1 (0.39) KDM4EUSP2HPGDNPSR1HSD17B10
SCHEMBL4164145 0.82 MPL (0.37) P2RX7MPLMAPK1HSD11B1CNR2
SCHEMBL4741483 0.81 OPRK1 (0.38) P2RX7KDM4EUSP2HPGDNPSR1
SCHEMBL3929514 0.79 P2RY12 (0.39) MAPK1KDM4EHPGDHSD17B10
SCHEMBL3934546 0.78 P2RX7 (0.32) P2RX7MPLMAPK1CNR2RORC
SCHEMBL4161653 0.77 TNF (0.32) P2RX7IL1BMAPK1TYRO3CNR2

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-20090018166-A1 New Pyridine Analogues X 161 ASTRAZENECA AB (SE) 2009-01-15 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-20090018166-A1 New Pyridine Analogues X 161 P2RY12, P2RY11, P2RY1 P2RX7 5/4885IL1B 481/4885MPL 45/4885

“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.