Tert-Butyl Formate

Tert-Butyl Formate

SCHEMBL28298094

CC(C)(C)OC=O.O=C(Cl)C1CCNC1

nearest known ligand 0.42

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Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.41
SSTR4 P31391 4/20 0.33
SSTR1 P30872 3/20 0.33
HTR2C P28335 1/20 0.33
SLC6A1 P30531 4/20 0.33
SLC6A11 P48066 3/20 0.33
SLC6A13 Q9NSD5 3/20 0.33
TSHR P16473 2/20 0.33
LMNA P02545 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
GABRA5 P31644 3/20 0.32
GABRB2 P47870 3/20 0.32
GABRA1 P14867 2/20 0.32
GABRA4 P48169 2/20 0.32
GABRP O00591 1/20 0.32
GABRD O14764 1/20 0.32
GABRB1 P18505 1/20 0.32
GABRG2 P18507 1/20 0.32
GABRB3 P28472 1/20 0.32
GABRA3 P34903 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 SCHEMBL27566302 0.90 TDP1 (0.43) TDP1SSTR4SSTR1TSHRSMN1; SMN2
Tert-Butyl Formate SCHEMBL28122924 0.86 SLC6A1 (0.49) TDP1SSTR4SSTR1HTR2CSLC6A1
Tert-Butyl Formate SCHEMBL27935424 0.86 TDP1 (0.42) TDP1SSTR4SSTR1HTR2CSLC6A1
Tert-Butyl Formate SCHEMBL27950766 0.86 TDP1 (0.42) TDP1SSTR4SSTR1HTR2CSLC6A1
Tert-Butyl Formate SCHEMBL28839934 0.84 KMT2A (0.50) TDP1SSTR4SSTR1HTR2CSLC6A1
Tert-Butyl Formate SCHEMBL28125893 0.84 KMT2A (0.50) TDP1SSTR4SSTR1HTR2CSLC6A1
Tert-Butyl Formate SCHEMBL27676212 0.81 TDP1 (0.52) TDP1
Tert-Butyl Formate SCHEMBL28092073 0.81 HTR2C (0.38) TDP1SSTR4SSTR1HTR2CSMN1; SMN2
Tert-Butyl Formate SCHEMBL27836131 0.80 TDP1 (0.39) TDP1KDM4EMAPTKMT2AATM
Tert-Butyl Formate SCHEMBL27751950 0.80 TDP1 (0.50) TDP1SSTR4SSTR1TSHRGABRA5

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-109790143-A Amine-linked C for target protein degradation3-glutarimide solution stator body C4医药公司 2019-05-21 CN disclosed