SCHEMBL29975223

SCHEMBL29975223

CC(C)(C)OC(=O)CCCC(=O)NCCOCCOCCC(=O)O

nearest known ligand 0.41

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
TLR2 O60603 3/20 0.41
TLR1 Q15399 2/20 0.41
TSHR P16473 3/20 0.41
EPHX2 P34913 1/20 0.36
RECQL P46063 1/20 0.36
GLP1R P43220 8/20 0.35
EPOR P19235 1/20 0.34
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34
LMNA P02545 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34

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
SCHEMBL1509997 0.96 TLR2 (0.45) TLR2TLR1TSHREPHX2RECQL
SCHEMBL3093395 0.96 TLR2 (0.45) TLR2TLR1TSHREPHX2RECQL
SCHEMBL29971767 0.94 TLR2 (0.43) TLR2TLR1TSHREPHX2RECQL
SCHEMBL29595879 0.94 TLR2 (0.43) TLR2TLR1TSHREPHX2RECQL
SCHEMBL25330597 0.92 TLR2 (0.41) TLR2TLR1TSHREPHX2GLP1R
SCHEMBL21611677 0.92 TLR2 (0.41) TLR2TLR1TSHREPHX2GLP1R
SCHEMBL1509876 0.90 TLR2 (0.43) TLR2TLR1TSHREPHX2RECQL
SCHEMBL1509850 0.90 TLR2 (0.43) TLR2TLR1TSHREPHX2RECQL
SCHEMBL29594603 0.89 TLR2 (0.41) TLR2TLR1TSHREPHX2GLP1R
SCHEMBL23051865 0.88 GLP1R (0.45) TLR2TLR1TSHREPHX2RECQL

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-115504924-A Hydrazino-pyrrolo compounds and methods for forming conjugates 雷德伍德生物科技股份有限公司 2022-12-23 CN disclosed
CN-105744935-B Hydrazino-pyrrolo compounds and methods for forming conjugates 雷德伍德生物科技股份有限公司 2022-09-30 CN disclosed