SCHEMBL15894530

SCHEMBL15894530

CC(C)(C)[Si](C)(C)OCCCNC(=O)OCCNc1ccn2ncc(Br)c2n1

nearest known ligand 0.35

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
RET P07949 5/20 0.35
PCSK9 Q8NBP7 1/20 0.34
IRAK4 Q9NWZ3 2/20 0.34
SUV39H2 Q9H5I1 2/20 0.33
DUT P33316 1/20 0.33
PIM1 P11309 8/20 0.33
PIM2 Q9P1W9 3/20 0.33
CHEK1 O14757 1/20 0.32
CSNK2A2 P19784 1/20 0.32
CDK2 P24941 1/20 0.32
CSNK2B P67870 1/20 0.32
CSNK2A1 P68400 1/20 0.32
PIM3 Q86V86 1/20 0.32
KDR P35968 1/20 0.32
JAK2 O60674 1/20 0.31
NTRK1 P04629 1/20 0.31

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
SCHEMBL17464320 0.84 RET (0.38) RETDUTPIM1PIM2CHEK1
SCHEMBL15894562 0.83 FYN (0.45) RETPIM1PIM2CHEK1CSNK2A2
SCHEMBL16154316 0.82 DUT (0.38) RETDUTPIM1PIM2CHEK1
SCHEMBL16088289 0.80 STK17B (0.47) PCSK9SUV39H2PIM1PIM2JAK2
SCHEMBL17077959 0.79 RET (0.41) RETPCSK9IRAK4PIM1PIM2
SCHEMBL15891374 0.78 RET (0.40) RETPCSK9IRAK4SUV39H2PIM1
SCHEMBL15894555 0.78 SUV39H2 (0.51) RETPCSK9IRAK4SUV39H2PIM1
SCHEMBL30103007 0.74 PIM1 (0.40) RETIRAK4PIM1PIM2KDR
SCHEMBL15891391 0.73 CA12 (0.45) PCSK9IRAK4SUV39H2JAK2NTRK1
SCHEMBL15891328 0.72 RET (0.41) RETPCSK9IRAK4SUV39H2PIM1

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-9096609-B2 Macrocyclic LRRK2 kinase inhibitors IPSEN PHARMA S.A.S. (FR) 2015-08-04 US disclosed
US-20140206683-A1 MACROCYCLIC LRRK2 KINASE INHIBITORS ONCODESIGN S.A. (FR) 2014-07-24 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-20140206683-A1 MACROCYCLIC LRRK2 KINASE INHIBITORS LRRK2, PINK1, PARK7 RET 404/4885PCSK9 676/4885IRAK4 568/4885

“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.