SCHEMBL28079608

SCHEMBL28079608

COC(=O)C(OO)C(=O)O

nearest known ligand 0.41

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.41
SMN1; SMN2 Q16637 2/20 0.40
CA14 Q9ULX7 2/20 0.34
CA12 O43570 1/20 0.32
ALDH1A1 P00352 1/20 0.32
MME P08473 2/20 0.32
CA1 P00915 1/20 0.31
CA2 P00918 1/20 0.31
SLC1A3 P43003 1/20 0.31
SLC1A2 P43004 1/20 0.31
SLC1A1 P43005 1/20 0.31
TP53 P04637 1/20 0.30
TGFBR1 P36897 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
SCHEMBL276322 0.81 KMT2A (0.43) KMT2ASMN1; SMN2CA14CA12ALDH1A1
SCHEMBL27409877 0.79 SMN1; SMN2 (0.40) KMT2ASMN1; SMN2CA14CA12ALDH1A1
SCHEMBL7715983 0.77 KMT2A (0.40) KMT2ASMN1; SMN2CA14CA12ALDH1A1
SCHEMBL27961549 0.76
SCHEMBL275279 0.71 SMN1; SMN2 (0.48) KMT2ASMN1; SMN2CA14CA12ALDH1A1
SCHEMBL3005395 0.71 SMN1; SMN2 (0.48) KMT2ASMN1; SMN2CA14CA12ALDH1A1
SCHEMBL27870068 0.70 CA1 (0.38) KMT2ASMN1; SMN2ALDH1A1MMECA1
SCHEMBL1427169 0.67
SCHEMBL5701177 0.67 SMN1; SMN2 (0.57) KMT2ASMN1; SMN2CA14CA12ALDH1A1
SCHEMBL10011638 0.67 SMN1; SMN2 (0.43) KMT2ASMN1; SMN2CA14CA12ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-107079924-A Enhanced antimicrobial superacid composite and the method used at reduced temperatures in sterile cleaning 艺康美国股份有限公司 2017-08-22 CN disclosed
CN-103826453-B Enhanced antimicrobial peracid compositions and methods for use in aseptic cleaning at reduced temperatures 艺康美国股份有限公司 2017-04-26 CN disclosed
CN-103732063-B Deodorization of peracids 艺康美国股份有限公司 2016-07-20 CN disclosed