Tert-Butyl Formate

Tert-Butyl Formate

SCHEMBL28077893

CC(C)(C)OC=O.CON=Cc1c(N)ncnc1N1CCNCC1

nearest known ligand 0.52

Full drug profile on Sugi Atlas →

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ FLT3 P36888 15/20 0.52
▸ PDGFRB P09619 1/20 0.49
▸ KIT P10721 1/20 0.49
▸ RET P07949 1/20 0.39
▸ KDR P35968 3/20 0.38
▸ HTR2C P28335 1/20 0.37

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
SCHEMBL13956850 0.89 FLT3 (0.55) FLT3PDGFRBKITRETKDR
SCHEMBL5135470 0.89 FLT3 (0.55) FLT3PDGFRBKITRETKDR
SCHEMBL3884998 0.84 FLT3 (0.55) FLT3PDGFRBKITRETKDR
Trifluoroacetic Acid SCHEMBL3882180 0.83 FLT3 (0.54) FLT3PDGFRBKITRETKDR
SCHEMBL28775244 0.80 FLT3 (0.66) FLT3PDGFRBKITKDR
SCHEMBL27734124 0.79 FLT3 (0.67) FLT3PDGFRBKITKDR
SCHEMBL27734330 0.79 FLT3 (0.67) FLT3PDGFRBKIT
Tert-Butyl Formate SCHEMBL27644427 0.78 RPS6KB1 (0.42) HTR2C
Tert-Butyl Formate SCHEMBL28077894 0.78 HTR2C (0.39) FLT3PDGFRBKITHTR2C
SCHEMBL27734245 0.77 FLT3 (0.68) FLT3PDGFRBKITRETKDR

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
CN-106045918-B Substituted uracil derivative and the preparation method and application thereof with Akt inhibitory activity 山东大学 2019-02-01 — — CN disclosed
CN-106045918-A Substituted pyrimidine derivatives with Akt inhibiting activity, and preparation method and application thereof 山东大学 2016-10-26 — — CN disclosed
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