SCHEMBL25876302

SCHEMBL25876302

COC(=O)C1(OC)CCC(c2nc(Nc3cc(C)[nH]n3)c3cnn(CC(F)(F)F)c3n2)CC1

nearest known ligand 0.51

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PLK4 O00444 15/20 0.51
RET P07949 3/20 0.44
JAK2 O60674 1/20 0.44
KIF5B P33176 1/20 0.44
KDR P35968 1/20 0.44
FLT3 P36888 1/20 0.44
CCDC6 Q16204 1/20 0.44
PAK4 O96013 3/20 0.43
AURKA O14965 1/20 0.41
SYK P43405 1/20 0.41
AURKB Q96GD4 1/20 0.41
PDE2A O00408 1/20 0.36
NTRK1 P04629 6/20 0.36

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
SCHEMBL25876318 0.94 PLK4 (0.51) PLK4RETJAK2KIF5BKDR
SCHEMBL25876216 0.92 PLK4 (0.52) PLK4RETJAK2KIF5BKDR
SCHEMBL25876231 0.91 RET (0.45) PLK4RETJAK2KIF5BKDR
SCHEMBL25875939 0.91 RET (0.44) PLK4RETJAK2KIF5BKDR
SCHEMBL25875987 0.89 RET (0.47) PLK4RETJAK2KIF5BKDR
SCHEMBL25876277 0.89 RET (0.43) PLK4RETJAK2KIF5BKDR
SCHEMBL25876081 0.89 RET (0.43) PLK4RETJAK2KIF5BKDR
SCHEMBL25876039 0.89 RET (0.43) PLK4RETJAK2KIF5BKDR
SCHEMBL25875753 0.86 RET (0.46) PLK4RETJAK2KIF5BKDR
SCHEMBL25876129 0.86 PLK4 (0.46) PLK4RETJAK2KIF5BKDR

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-20230234954-A1 COMPOUND USED AS RET KINASE INHIBITOR AND APPLICATION THEREOF TYK MEDICINES, INC. (CN) 2023-07-27 US disclosed
US-20230234954-A1 COMPOUND USED AS RET KINASE INHIBITOR AND APPLICATION THEREOF TYK MEDICINES, INC. (CN) 2023-07-27 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-20230234954-A1 COMPOUND USED AS RET KINASE INHIBITOR AND APPLICATION THEREOF RET, ROR1, FGFR3 PLK4 1763/4885RET 1/4885JAK2 38/4885

“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.