SCHEMBL25923992

SCHEMBL25923992

NC(=O)CCN1CC2(CC(NC3CC3)C2)C1

nearest known ligand 0.40

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.40
KDM1A O60341 3/20 0.33
SMN1; SMN2 Q16637 1/20 0.32
TLR9 Q9NR96 1/20 0.31
TLR8 Q9NR97 1/20 0.31
TLR7 Q9NYK1 1/20 0.31
POLB P06746 1/20 0.30
HTT P42858 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
SCHEMBL21088777 0.86 KDM1A (0.40) KDM1A
SCHEMBL25924012 0.85 L3MBTL1 (0.45) L3MBTL1KDM1ASMN1; SMN2POLBHTT
SCHEMBL21088369 0.84 POLB (0.38) KDM1APOLB
SCHEMBL25923845 0.78 ALOX15 (0.33) KDM1A
SCHEMBL20106792 0.78 KDM1A (0.44) KDM1A
SCHEMBL21089313 0.77 EPHX2 (0.35) KDM1ASMN1; SMN2
SCHEMBL25923869 0.76 NPSR1 (0.33) KDM1AHTT
SCHEMBL25924094 0.76 OPRM1 (0.30)
SCHEMBL20106817 0.74 KDM1A (0.30) KDM1A
SCHEMBL25924057 0.73 ADH1B (0.31) KDM1A

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