Bucrylate

Bucrylate

SCHEMBL2789798

C=C(C#N)C(=O)OCC(C)C.CC(C)C/C(=C/C#N)C(=O)O

nearest known ligand 0.43

Full drug profile on Sugi Atlas →

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.43
ALDH1A1 P00352 3/20 0.43
MAPT P10636 2/20 0.32
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
KDM4E B2RXH2 1/20 0.31
THRB P10828 1/20 0.31
TP53 P04637 1/20 0.30

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
Bucrylate SCHEMBL168360 0.81 TSHR (0.62) TSHRALDH1A1MAPTMEN1KMT2A
SCHEMBL25698 0.80 GRIK1 (0.38) ALDH1A1
SCHEMBL25697 0.80 GRIK1 (0.38) ALDH1A1
Bucrylate SCHEMBL2789800 0.75 ALDH1A1 (0.44) TSHRALDH1A1MAPTMEN1KMT2A
SCHEMBL11875434 0.71 TSHR (0.53) TSHRALDH1A1MAPTMEN1KMT2A
Bucrylate SCHEMBL11068456 0.71 TSHR (0.53) TSHRALDH1A1MAPTMEN1KMT2A
SCHEMBL28040004 0.70 ALDH1A1 (0.47) TSHRALDH1A1MAPTMEN1KMT2A
SCHEMBL440284 0.70 TSHR (0.56) TSHRALDH1A1MAPTMEN1KMT2A
SCHEMBL28021484 0.70 TSHR (0.60) TSHRALDH1A1MAPT
SCHEMBL9576004 0.69 TSHR (0.50) TSHRALDH1A1MAPTMEN1KMT2A

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11389171-B2 Integrated system for the infixion and retrieval of implants GOLDSMITH DAVID S (US) 2022-07-19 US disclosed
US-20210145445-A9 Integrated system for the infixion and retrieval of implants GOLDSMITH DAVID S (US) 2021-05-20 US disclosed
US-20190247050-A1 Integrated system for the infixion and retrieval of implants GOLDSMITH DAVID S (US) 2019-08-15 US disclosed
US-20140163664-A1 Integrated system for the ballistic and nonballistic infixion and retrieval of implants with or without drug targeting GOLDSMITH DAVID S (US) 2014-06-12 US disclosed
US-20100286791-A1 Integrated system for the ballistic and nonballistic infixion and retrieval of implants GOLDSMITH DAVID S 2010-11-11 US disclosed