Tert-Butyl Formate

Tert-Butyl Formate

SCHEMBL28087005

CC(C)(C)OC=O.CC(OC1CCNCC1)c1ccc(Cl)cc1

nearest known ligand 0.40

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Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
SLC6A4 P31645 7/20 0.40
SLC6A2 P23975 4/20 0.40
SLC6A3 Q01959 4/20 0.40
HTR2C P28335 2/20 0.37
HTR2B P41595 2/20 0.37
HTR6 P50406 2/20 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
Tert-Butyl Formate SCHEMBL28006494 0.79 SLC6A4 (0.46) SLC6A4SLC6A2SLC6A3
Tert-Butyl Formate SCHEMBL28006492 0.79 SLC6A4 (0.46) SLC6A4SLC6A2SLC6A3
Tert-Butyl Formate SCHEMBL28006799 0.77 SLC6A4 (0.44) SLC6A4SLC6A2SLC6A3
Tert-Butyl Formate SCHEMBL28096252 0.76 HTR3A (0.53) HTR2CHTR6
Tert-Butyl Formate SCHEMBL28818067 0.76 SLC6A2 (0.55) SLC6A4SLC6A2SLC6A3
Tert-Butyl Formate SCHEMBL28087004 0.74 HRH1 (0.39) SLC6A4SLC6A2SLC6A3HTR2CHTR2B
Tert-Butyl Formate SCHEMBL28078907 0.73 HRH1 (0.43) SLC6A4HTR2CHTR2B
Tert-Butyl Formate SCHEMBL28875402 0.72 MEN1 (0.54)
Tert-Butyl Formate SCHEMBL28006499 0.72 FPR2 (0.42) SLC6A4SLC6A2SLC6A3HTR6
SCHEMBL4190405 0.72 DRD3 (0.55) SLC6A4SLC6A2SLC6A3

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-104520292-B Sulphonylpiperidine derivant and they are for treating the purposes of disease of front dynein mediation 武田药品工业株式会社 2016-09-14 CN disclosed