SCHEMBL29029014

SCHEMBL29029014

C=CCNC(=O)O.CC1OC1O

nearest known ligand 0.41

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 1/20 0.41
TSHR P16473 2/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
MAPT P10636 1/20 0.39
FAAH O00519 1/20 0.37
HPGD P15428 4/20 0.35
ALDH1A1 P00352 4/20 0.35
NPSR1 Q6W5P4 3/20 0.35
LMNA P02545 2/20 0.34
PKM P14618 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33

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
Methyl Alcohol SCHEMBL4257818 0.81
SCHEMBL29988 0.81
SCHEMBL29072942 0.79
Water SCHEMBL11780636 0.79
Hydrochloric Acid SCHEMBL11168200 0.79
Ammonia Solution, Strong SCHEMBL6395522 0.79
Methoxymethane SCHEMBL8518876 0.77 SMN1; SMN2 (0.46) KMT2ATSHRSMN1; SMN2MAPTFAAH
Acrylic Acid SCHEMBL4796311 0.74 LMNA (0.50) KMT2ATSHRSMN1; SMN2MAPTFAAH
Allylamine SCHEMBL10887662 0.73 TSHR (0.46) KMT2ATSHRSMN1; SMN2MAPTFAAH
Acrylic Acid SCHEMBL10349799 0.72 LMNA (0.53) TSHRALDH1A1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116368168-A Novel antimicrobial and antithrombotic medical device 列日大学 2023-06-30 CN claimed
CN-116368168-A Novel antimicrobial and antithrombotic medical device 列日大学 2023-06-30 CN disclosed