SCHEMBL8200267

SCHEMBL8200267

CCS(=O)(=O)OC(=O)[C@H](C)N

nearest known ligand 0.33

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TP53 P04637 1/20 0.33
ALOX15 P16050 1/20 0.32
GRIN2D O15399 1/20 0.32
GRIN3B O60391 1/20 0.32
GRIN1 Q05586 1/20 0.32
GRIN2A Q12879 1/20 0.32
GRIN2B Q13224 1/20 0.32
GRIN2C Q14957 1/20 0.32
GRIN3A Q8TCU5 1/20 0.32
GCLC P48506 1/20 0.32
CHRNB2 P17787 1/20 0.31
CHRNB4 P30926 1/20 0.31
CHRNA3 P32297 1/20 0.31
CHRNA4 P43681 1/20 0.31
CA14 Q9ULX7 1/20 0.31
CYP3A4 P08684 2/20 0.31
CYP1A2 P05177 1/20 0.31
CYP2D6 P10635 1/20 0.31
CYP2C9 P11712 1/20 0.31
NFKB1 P19838 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
SCHEMBL28668410 0.83 SLC7A5 (0.39) TP53ALOX15CA14
SCHEMBL3799351 0.81 LMNA (0.34) CYP2C19LMNA
SCHEMBL28673353 0.79 DPP4 (0.40)
SCHEMBL27541492 0.78 PMP22 (0.31) ALOX15GCLCPMP22
SCHEMBL15016477 0.78 MEN1 (0.34)
SCHEMBL2364900 0.76 CA14 (0.33) TP53GRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL5133559 0.76 ALDH1A1 (0.36) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL7297529 0.76 CA14 (0.33) TP53GRIN2DGRIN3BGRIN1GRIN2A
Ammonia Solution, Strong SCHEMBL27282764 0.74 CA14 (0.32) TP53CA14
Sulfuric Acid SCHEMBL10354951 0.73 TP53 (0.47) TP53ALOX15GRIN2DGRIN3BGRIN1

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
US-6140123-A PREPARING TISSUES FOR STORAGE IN FREEZING CONDITIONS; SUSPENSION OF TISSUE IN AND FREEZING CEDARS-SINAI MEDICAL CENTER (US) 2000-10-31 US disclosed