SCHEMBL25924012

SCHEMBL25924012

NC(=O)CCN1CCC2(CC1)CC(NC1CC1)C2

nearest known ligand 0.45

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.45
SMN1; SMN2 Q16637 1/20 0.36
ITGB3 P05106 2/20 0.35
ITGA2B P08514 2/20 0.35
POLB P06746 1/20 0.35
HTT P42858 1/20 0.35
KDM1A O60341 2/20 0.33
MAPT P10636 1/20 0.32
KDM4E B2RXH2 2/20 0.30
LMNA P02545 2/20 0.30
MAPK1 P28482 1/20 0.30
HIF1A Q16665 1/20 0.30
MEN1 O00255 1/20 0.30
KMT2A Q03164 1/20 0.30
SIGMAR1 Q99720 1/20 0.30

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
SCHEMBL21088883 0.87 KDM1A (0.44) SMN1; SMN2ITGB3ITGA2BPOLBHTT
SCHEMBL25923992 0.85 L3MBTL1 (0.40) L3MBTL1SMN1; SMN2POLBHTTKDM1A
SCHEMBL25923906 0.80 KDM1A (0.46) SMN1; SMN2KDM1AKDM4ELMNAKMT2A
SCHEMBL21088467 0.79 CNR1 (0.37) SMN1; SMN2KDM1A
SCHEMBL25923937 0.77 KDM1A (0.40) KDM1A
SCHEMBL25924008 0.76 KDM1A (0.32) KDM1A
SCHEMBL31269932 0.74 L3MBTL1 (0.62) L3MBTL1SMN1; SMN2ITGB3ITGA2BPOLB
SCHEMBL31269835 0.74 L3MBTL1 (0.62) L3MBTL1SMN1; SMN2ITGB3ITGA2BPOLB
SCHEMBL25923925 0.73 KDM1A (0.42) KDM1A
SCHEMBL31270000 0.73 L3MBTL1 (0.66) L3MBTL1SMN1; SMN2ITGB3ITGA2BPOLB

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-3532459-B1 LSD1 INHIBITORS AND MEDICAL USES THEREOF CONSTELLATION PHARMACEUTICALS INC (US) 2023-08-02 EP disclosed