SCHEMBL8001867

SCHEMBL8001867

CCCCCCCCCCCCCCCCCCNC(=O)[C@H](CO)NC(=O)OCC1c2ccccc2-c2ccccc21

nearest known ligand 0.61

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
TLR2 O60603 6/20 0.56
KMT2A Q03164 1/20 0.55
TNF P01375 2/20 0.49

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
SCHEMBL20411431 0.92 TLR2 (0.63) TLR2KMT2A
SCHEMBL20411430 0.92 TLR2 (0.63) TLR2KMT2A
SCHEMBL13083570 0.92 KMT2A (0.57) TLR2KMT2A
SCHEMBL5493804 0.90 KMT2A (0.65) TLR2KMT2ATNF
SCHEMBL3795683 0.90 KMT2A (0.56) TLR2KMT2ATNF
SCHEMBL19919108 0.90 TLR2 (0.64) TLR2KMT2A
SCHEMBL13124052 0.90 TLR2 (0.55) TLR2KMT2A
SCHEMBL3792460 0.90 KMT2A (0.56) TLR2KMT2ATNF
SCHEMBL3795594 0.90 KMT2A (0.56) TLR2KMT2ATNF
SCHEMBL5493800 0.90 KMT2A (0.65) TLR2KMT2ATNF

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
US-6046040-A Method for producing glycoconjugates TOYO BOSEKI KABUSHIKI KAISHA (JP) 2000-04-04 US disclosed
EP-0897014-A2 Method for producing glycoconjugates Toyo Boseki Kabushiki Kaisha (JP) 1999-02-17 EP disclosed