SCHEMBL25812431

SCHEMBL25812431

COC(=O)c1cnn2cc(-c3cnn(C)c3)cc(OS(=O)(=O)C(F)(F)F)c12

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RET P07949 13/20 0.39
KIT P10721 2/20 0.37
ALPL P05186 2/20 0.37
PDK2 Q15119 1/20 0.36
ERN1 O75460 1/20 0.36
JAK1 P23458 2/20 0.35
JAK3 P52333 2/20 0.35
SGK1 O00141 1/20 0.35
PIK3CD O00329 1/20 0.35
CHEK1 O14757 1/20 0.35
MAPK13 O15264 1/20 0.35
PDPK1 O15530 1/20 0.35
NUAK1 O60285 1/20 0.35
CCNT1 O60563 1/20 0.35
JAK2 O60674 1/20 0.35
ROCK2 O75116 1/20 0.35
CHEK2 O96017 1/20 0.35
EGFR P00533 1/20 0.35
RAF1 P04049 1/20 0.35
NTRK1 P04629 1/20 0.35

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
SCHEMBL25436701 0.89 RET (0.37) RETJAK1JAK3PIK3CD
SCHEMBL25255720 0.89 CCNC (0.37) RETKITALPLJAK1JAK3
SCHEMBL23501370 0.89 MKNK1 (0.42) RETPDK2JAK1JAK3JAK2
SCHEMBL25812405 0.87 RET (0.39) RETGSK3BDYRK1A
SCHEMBL25424992 0.87 TTK (0.37) RETPDK2JAK1JAK3
SCHEMBL23501298 0.87 MKNK1 (0.37) RET
SCHEMBL25426039 0.87 MARK3 (0.42) RETKITJAK1JAK3SGK1
SCHEMBL23501130 0.84 ERN1 (0.47) RETERN1
SCHEMBL23501170 0.83 PIK3CG (0.42) RETKITALPLJAK1JAK3
SCHEMBL18390425 0.83 RET (0.42) RETALPLERN1SYK

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-20230219979-A1 PYRAZOLO[1,5-a]PYRIDINE COMPOUND, PREPARATION METHOD THEREFOR AND USE THEREOF SHENZHEN ZHONGGE BIOLOGICAL TECHNOLOGY CO., LTD. (CN) 2023-07-13 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-20230219979-A1 PYRAZOLO[1,5-a]PYRIDINE COMPOUND, PREPARATION METHOD THEREFOR AND USE THEREOF RET, GRK4, RIN1 RET 1/4885KIT 71/4885ALPL 2348/4885

“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.