SCHEMBL29040544

SCHEMBL29040544

O=C(O)CCNCC(CC(=O)O)S(=O)(=O)O

nearest known ligand 0.33

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ECE1 P42892 2/20 0.33
TDP1 Q9NUW8 1/20 0.32
FOLH1 Q04609 1/20 0.31
APEX1 P27695 1/20 0.31
PRMT1 Q99873 1/20 0.31
FABP4 P15090 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
SCHEMBL21999079 0.76 FOLH1 (0.38) TDP1FOLH1APEX1
SCHEMBL11927646 0.76 PHF8 (0.38) ECE1TDP1FOLH1APEX1
SCHEMBL3142793 0.75 TDP1 (0.48) TDP1FOLH1APEX1
SCHEMBL10932851 0.74 FOLH1 (0.46) TDP1FOLH1APEX1
SCHEMBL9402802 0.72 FOLH1 (0.45) TDP1FOLH1APEX1
SCHEMBL28221122 0.72 FOLH1 (0.45) TDP1FOLH1APEX1
SCHEMBL28220537 0.72 FOLH1 (0.45) TDP1FOLH1APEX1
SCHEMBL11879043 0.71 ENPEP (0.38) ECE1FOLH1
SCHEMBL10800661 0.69 LMNA (0.38) ECE1FOLH1PRMT1
SCHEMBL5014963 0.69 LMNA (0.38) ECE1FOLH1

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-110651030-B Cleaning composition and use thereof 诺维信公司 2023-10-13 CN disclosed
CN-111770788-B Microencapsulation using amino sugar oligomers 诺维信公司 2023-07-25 CN disclosed