SCHEMBL24378064

SCHEMBL24378064

CCOC(O)c1nn(C)c(C)c1Br

nearest known ligand 0.32

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
CSNK2A1 P68400 5/20 0.32
ALDH1A1 P00352 2/20 0.31
NPSR1 Q6W5P4 1/20 0.31
TP53 P04637 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
SCHEMBL22436700 0.79 CSNK2A1 (0.36) LMNASMN1; SMN2CSNK2A1ALDH1A1
SCHEMBL30679098 0.79 CSNK2A1 (0.36) LMNASMN1; SMN2CSNK2A1ALDH1A1
SCHEMBL14043734 0.76 CSNK2A1 (0.36) LMNASMN1; SMN2CSNK2A1
SCHEMBL30679115 0.76 CSNK2A1 (0.36) LMNASMN1; SMN2CSNK2A1
SCHEMBL22436737 0.72 CSNK2A1 (0.35) CSNK2A1ALDH1A1
SCHEMBL30679095 0.72 CSNK2A1 (0.35) CSNK2A1ALDH1A1
SCHEMBL24593558 0.71 NPC1 (0.31) LMNASMN1; SMN2CSNK2A1
SCHEMBL22436767 0.70 CSNK2A1 (0.31) CSNK2A1ALDH1A1
SCHEMBL22436734 0.70 NPC1 (0.31) LMNASMN1; SMN2CSNK2A1ALDH1A1
SCHEMBL30679059 0.70 NPC1 (0.31) LMNASMN1; SMN2CSNK2A1ALDH1A1

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
EP-3458459-B1 MACROCYCLIC INDOLE DERIVATIVES BAYER AG (DE) 2022-04-27 EP disclosed