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Tert-Butyl Formate

Tert-Butyl Formate

SCHEMBL27906331

CC(C)(C)OC=O.O=C1CCCN1CC1CCNCC1

nearest known ligand 0.41

Full drug profile on Sugi Atlas →

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ DRD2 P14416 1/20 0.36
▸ KDM4E B2RXH2 1/20 0.35
▸ L3MBTL1 Q9Y468 1/20 0.35
▸ FPR2 P25090 1/20 0.34
▸ PIK3CD O00329 1/20 0.34
▸ LTA4H P09960 2/20 0.34
▸ KDM1A O60341 1/20 0.34

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 SCHEMBL27591838 0.85 DRD2 (0.36) DRD2FPR2KDM1A
SCHEMBL255185 0.84 KDM4E (0.44) DRD2KDM4EL3MBTL1FPR2PIK3CD
Hydrochloric Acid SCHEMBL190200 0.82 KDM4E (0.43) DRD2KDM4EL3MBTL1FPR2PIK3CD
Hydrochloric Acid SCHEMBL9148103 0.81 KDM4E (0.42) DRD2KDM4EL3MBTL1FPR2PIK3CD
SCHEMBL26131264 0.79 DRD2 (0.41) DRD2KDM4EL3MBTL1FPR2LTA4H
Hydrochloric Acid SCHEMBL26130653 0.78 DRD2 (0.40) DRD2KDM4EL3MBTL1FPR2LTA4H
SCHEMBL26128730 0.78 L3MBTL1 (0.41) DRD2KDM4EL3MBTL1FPR2
Tert-Butyl Formate SCHEMBL28330700 0.77 TDP1 (0.39) DRD2KDM1A
SCHEMBL22340533 0.76 KDM4E (0.43) DRD2KDM4EL3MBTL1PIK3CDLTA4H
SCHEMBL26129643 0.75 SLC6A2 (0.40) DRD2KDM4EL3MBTL1PIK3CD

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
CN-101479274-B Pharmaceutical compounds HOFFMANN LA ROCHE 2013-06-12 — — CN disclosed