SCHEMBL21384437

SCHEMBL21384437

CC(=O)N[C@@H]1C[C@H]2CNC[C@H]2C1

nearest known ligand 0.53

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ATM Q13315 1/20 0.53
ALDH1A1 P00352 2/20 0.50
KDM4E B2RXH2 1/20 0.50
CHRNB2 P17787 13/20 0.48
CHRNA4 P43681 13/20 0.48
CHRNB4 P30926 11/20 0.48
CHRNA3 P32297 11/20 0.48
CHRNA7 P36544 9/20 0.48
HPSE Q9Y251 1/20 0.34
OGA O60502 1/20 0.34
TLR4 O00206 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
SCHEMBL12862715 1.00 ATM (0.53) ATMALDH1A1KDM4ECHRNB2CHRNA4
SCHEMBL21384439 1.00 ATM (0.53) ATMALDH1A1KDM4ECHRNB2CHRNA4
SCHEMBL12192598 1.00 ATM (0.53) ATMALDH1A1KDM4ECHRNB2CHRNA4
SCHEMBL14428333 0.82 ATM (0.52) ATMALDH1A1KDM4ECHRNB2CHRNA4
SCHEMBL47794 0.81
SCHEMBL16174441 0.80 CHRNB2 (0.50) ATMCHRNB2CHRNA4CHRNB4CHRNA3
SCHEMBL11889584 0.80 CHRNB2 (0.50) ATMCHRNB2CHRNA4CHRNB4CHRNA3
SCHEMBL22233131 0.80 CHRNB2 (0.50) ATMCHRNB2CHRNA4CHRNB4CHRNA3
SCHEMBL11889583 0.80 CHRNB2 (0.50) ATMCHRNB2CHRNA4CHRNB4CHRNA3
Hydrochloric Acid SCHEMBL6616254 0.79

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
EP-3768660-A1 MODULATORS OF EUKARYOTIC INITIATION FACTOR 2 Denali Therapeutics Inc. (US) 2021-01-27 EP disclosed
WO-2019183589-A1 MODULATORS OF EUKARYOTIC INITIATION FACTOR 2 DENALI THERAPEUTICS INC. (US) 2019-09-26 WO disclosed