SCHEMBL24176335

SCHEMBL24176335

C=C1C=CC(=O)N1C(C)CC

nearest known ligand 0.37

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MGLL Q99685 4/20 0.37
GMNN O75496 1/20 0.37
ALDH1A1 P00352 1/20 0.37
LMNA P02545 1/20 0.37
MAPT P10636 1/20 0.37
THPO P40225 1/20 0.37
BLM P54132 1/20 0.37
PMP22 Q01453 1/20 0.37
NPSR1 Q6W5P4 1/20 0.37
GSK3A P49840 1/20 0.31
GSK3B P49841 1/20 0.31
PTGS1 P23219 3/20 0.31
PTGS2 P35354 3/20 0.31
FAAH O00519 1/20 0.31

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
SCHEMBL209740 0.85 MGLL (0.44) MGLLGMNNALDH1A1LMNAMAPT
SCHEMBL24650077 0.82 MGLL (0.38) MGLLGMNNALDH1A1LMNAMAPT
SCHEMBL12119959 0.79 MGLL (0.36) MGLLGMNNALDH1A1LMNAMAPT
SCHEMBL20132314 0.74
SCHEMBL10036478 0.72
SCHEMBL21728710 0.72 GSK3A (0.31) MGLLGSK3AGSK3B
SCHEMBL13448321 0.72 GSK3A (0.31) MGLLGSK3AGSK3B
SCHEMBL20806156 0.69 MGLL (0.38) MGLLGMNNALDH1A1LMNAMAPT
SCHEMBL1535518 0.69 MGLL (0.46) MGLLGMNNALDH1A1LMNAMAPT
SCHEMBL7882002 0.69 MGLL (0.46) MGLLGMNNALDH1A1LMNAMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2022001864-A1 ANTIBODY-DRUG CONJUGATE AND PREPARATION METHOD THEREFOR AND USE THEREOF 昆山新蕴达生物科技有限公司 2022-01-06 WO disclosed