Tert-Butyl Formate

Tert-Butyl Formate

SCHEMBL27645429

CC(C)(C)OC=O.CCNC1(C(N)=O)CNC1

nearest known ligand 0.37

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Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.37
CNR1 P21554 1/20 0.33
KDM4E B2RXH2 1/20 0.32
KMT2A Q03164 1/20 0.32

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
Tert-Butyl Formate SCHEMBL27645418 0.84 KDM4E (0.45) TDP1KDM4EKMT2A
SCHEMBL3554211 0.83 KMT2A (0.42) CNR1KDM4EKMT2A
Hydrochloric Acid SCHEMBL4837442 0.81 KDM4E (0.41) CNR1KDM4EKMT2A
Tert-Butyl Formate SCHEMBL27645414 0.72 KDM4E (0.68) TDP1KDM4EKMT2A
Tert-Butyl Formate SCHEMBL28056935 0.72 TDP1 (0.45) TDP1
Tert-Butyl Formate SCHEMBL27666527 0.72 TDP1 (0.41) TDP1KDM4EKMT2A
SCHEMBL3561349 0.70 KDM4E (0.55) CNR1KDM4EKMT2A
Tert-Butyl Formate SCHEMBL28078891 0.69 TDP1 (0.45) TDP1
Tert-Butyl Formate SCHEMBL27947174 0.69 TDP1 (0.54) TDP1
SCHEMBL5395425 0.68 KDM4E (0.43) CNR1KDM4EKMT2A

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-1914182-B Quinazoline derivatives ASTRAZENECA AB 2011-09-07 CN disclosed
CN-1914182-A Quinazoline derivatives ASTRAZENECA AB (SE) 2007-02-14 CN disclosed