SCHEMBL25129478

SCHEMBL25129478

C=C(C)C(=O)Nc1ccc(-c2cn3ncnc(N)c3c2-c2ccc(C(=O)N(C=C(C)C(=O)Nc3ccc(-c4cn5ncnc(N)c5c4-c4ccc(C(=O)O)cc4)cc3)CC(C)(C)O)cc2)cc1

nearest known ligand 0.33

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ FLT3 P36888 9/20 0.33
▸ PLK4 O00444 2/20 0.33
▸ AURKA O14965 2/20 0.33
▸ ROCK2 O75116 2/20 0.33
▸ ABL1 P00519 2/20 0.33
▸ NTRK1 P04629 2/20 0.33
▸ INSR P06213 2/20 0.33
▸ LCK P06239 2/20 0.33
▸ FYN P06241 2/20 0.33
▸ CSF1R P07333 2/20 0.33
▸ LYN P07948 2/20 0.33
▸ MET P08581 2/20 0.33
▸ KIT P10721 2/20 0.33
▸ FGFR1 P11362 2/20 0.33
▸ SRC P12931 2/20 0.33
▸ FLT1 P17948 2/20 0.33
▸ FGFR3 P22607 2/20 0.33
▸ RPS6KB1 P23443 2/20 0.33
▸ CDK2 P24941 2/20 0.33
▸ EPHA2 P29317 2/20 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
SCHEMBL22676019 0.84 AURKA (0.41) FLT3PLK4AURKAROCK2ABL1
SCHEMBL22676471 0.79 NAMPT (0.39) FLT3PLK4AURKAROCK2ABL1
SCHEMBL22678055 0.76 KDR (0.46) FLT3PLK4AURKAROCK2ABL1
SCHEMBL22676440 0.75 AURKA (0.37) FLT3PLK4AURKAROCK2ABL1
SCHEMBL22675819 0.74 NAMPT (0.41) FLT3PLK4AURKAROCK2ABL1
SCHEMBL22676167 0.73 ATR (0.41) FLT3PLK4AURKAROCK2ABL1
SCHEMBL22677079 0.73 AURKB (0.39) FLT3PLK4AURKAROCK2ABL1
SCHEMBL22676439 0.73 ATR (0.41) FLT3CDK8BTK
SCHEMBL22676715 0.72 AURKA (0.47) AURKAKDRCDK8AURKB
SCHEMBL22676469 0.70 AURKA (0.35) FLT3PLK4AURKAROCK2ABL1

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-20230192709-A1 FGFR INHIBITORS AND METHODS OF USE THEREOF RELAY THERAPEUTICS, INC. 2023-06-22 — — US disclosed
US-20230104574-A1 FGFR INHIBITORS AND METHODS OF USE THEREOF D.E. SHAW RESEARCH, LLC 2023-04-06 — — 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 (2 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-20230192709-A1 FGFR INHIBITORS AND METHODS OF USE THEREOF FGFR3, FGFR2, FGFR1 FLT3 20/4885PLK4 1908/4885AURKA 449/4885
US-20230104574-A1 FGFR INHIBITORS AND METHODS OF USE THEREOF FGFR3, FGFR2, FGFR1 FLT3 20/4885PLK4 1908/4885AURKA 449/4885

“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.

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