SCHEMBL25839734

SCHEMBL25839734

CC1CC(c2ccc(F)cc2)CN1C

nearest known ligand 0.43

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
KDM1A O60341 2/20 0.38
KDM4E B2RXH2 1/20 0.38
GAA P10253 1/20 0.38
MAPT P10636 1/20 0.38
ALDH1A1 P00352 1/20 0.37
HRH3 Q9Y5N1 2/20 0.36
SIGMAR1 Q99720 1/20 0.36
ATM Q13315 1/20 0.36
RECQL P46063 1/20 0.35
MAP1LC3B Q9GZQ8 1/20 0.35

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
SCHEMBL25839738 0.83 SLC6A2 (0.36) ALDH1A1HRH3MAP1LC3B
SCHEMBL7736890 0.81 BRD4 (0.46) KDM1A
SCHEMBL14877490 0.81 BRD4 (0.46) KDM1A
SCHEMBL13481229 0.81 BRD4 (0.46) KDM1A
SCHEMBL25839735 0.78 GAA (0.38) GAAMAPTHRH3
SCHEMBL15765688 0.74 SLC6A2 (0.42) KDM1AKDM4EGAAMAPTHRH3
SCHEMBL18019009 0.71 KDM1A (0.46) KDM1AATMRECQLMAP1LC3B
SCHEMBL25839739 0.70 DRD2 (0.48) HRH3SIGMAR1
SCHEMBL24112879 0.69 ALDH1A1 (0.49) MAPTALDH1A1
SCHEMBL13416053 0.68 NPC1 (0.47) MAPTATM

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-2023125825-A1 ANTICORONVIRAL COMPOUNDS AND COMPOSITIONS AND USES THEREOF SHANGHAI CUREGENE PHARMACEUTICAL CO., LTD. (CN) 2023-07-06 WO disclosed