Tert-Butyl Formate

Tert-Butyl Formate

SCHEMBL28064897

CC(C)(C)OC=O.O=C1CCNC(c2ccccc2)C1

nearest known ligand 0.37

Full drug profile on Sugi Atlas →

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
PRCP P42785 2/20 0.36
TDP1 Q9NUW8 1/20 0.35
SMN1; SMN2 Q16637 2/20 0.35
KMT2A Q03164 3/20 0.33
MEN1 O00255 2/20 0.33
LMNA P02545 1/20 0.33
BRD4 O60885 1/20 0.32
MAPT P10636 2/20 0.32
GAA P10253 2/20 0.32
USP2 O75604 1/20 0.32
ALDH1A1 P00352 1/20 0.32
TP53 P04637 1/20 0.32
HPGD P15428 1/20 0.32
ALOX12 P18054 1/20 0.32
RAB9A P51151 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32
RIPK1 Q13546 2/20 0.32
TSHR P16473 1/20 0.31
GSK3B P49841 1/20 0.31

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 SCHEMBL27626763 0.86 PRCP (0.44) PRCPTDP1SMN1; SMN2KMT2AMEN1
Tert-Butyl Formate SCHEMBL28209963 0.85 PRCP (0.35) PRCPTDP1SMN1; SMN2KMT2AMEN1
SCHEMBL2707254 0.84 PRCP (0.47) PRCPSMN1; SMN2KMT2AMEN1LMNA
SCHEMBL29330477 0.84 PRCP (0.47) PRCPSMN1; SMN2KMT2AMEN1LMNA
Hydrochloric Acid SCHEMBL29116034 0.82 PRCP (0.46) PRCPSMN1; SMN2KMT2AMEN1LMNA
Hydrochloric Acid SCHEMBL29116032 0.82 PRCP (0.46) PRCPSMN1; SMN2KMT2AMEN1LMNA
Tert-Butyl Formate SCHEMBL28828186 0.82 MEN1 (0.42) SMN1; SMN2KMT2AMEN1MAPTGAA
Tert-Butyl Formate SCHEMBL28065019 0.80 PRCP (0.31) PRCPTDP1
Tert-Butyl Formate SCHEMBL27651272 0.78 TDP1 (0.43) TDP1
Tert-Butyl Formate SCHEMBL28052001 0.78 TDP1 (0.43) TDP1

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-105579444-A Piperidinylindole derivatives and their use as complement factor B inhibitors NOVARTIS AG 2016-05-11 CN disclosed