SCHEMBL31662902

SCHEMBL31662902

O=C1CN(c2ccc(CN3C(=O)C(Cl)=C(Cl)C3O)cc2F)CCN1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.35
TSHR P16473 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
KDM4E B2RXH2 4/20 0.34
POLB P06746 2/20 0.33
PARP1 P09874 1/20 0.33
PARP2 Q9UGN5 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
METTL3 Q86U44 1/20 0.33
MCHR1 Q99705 1/20 0.32
HSD11B1 P28845 1/20 0.32
ADRA1D P25100 2/20 0.32
ADRA1A P35348 2/20 0.32
ADRA1B P35368 2/20 0.32
GRM2 Q14416 1/20 0.31
MAPKAPK2 P49137 1/20 0.31
MAPT P10636 2/20 0.31
PDE4A P27815 1/20 0.31
PDE4B Q07343 1/20 0.31
PDE4C Q08493 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
SCHEMBL31663172 0.84 RORC (0.39) ALDH1A1KDM4EPOLBMETTL3HSD11B1
SCHEMBL31662874 0.79 HPGDS (0.41) ALDH1A1KDM4E
SCHEMBL31662803 0.75 HTR1A (0.35) ALDH1A1KDM4EPOLB
SCHEMBL31662793 0.74 ALDH1A1 (0.36) ALDH1A1TSHRL3MBTL1POLBPARP1
SCHEMBL31662832 0.74 WNT3A (0.35) ALDH1A1HSD11B1
SCHEMBL23536039 0.73 PKM (0.48) HSD11B1GRM2MAPKAPK2CYP2C9CYP2C19
SCHEMBL29931790 0.73 PKM (0.48) HSD11B1GRM2MAPKAPK2CYP2C9CYP2C19
SCHEMBL31662701 0.73 HTR6 (0.37) POLBADRA1BMAPKAPK2MAPT
SCHEMBL31662775 0.72 ADRB1 (0.45) ALDH1A1TSHRKDM4EMAPKAPK2CYP2C9
SCHEMBL17962590 0.71 MDM2 (0.32)

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-2025147756-A1 VIRAL SENSITIZERS COMPOSITIONS, METHODS AND USES THEREOF OTTAWA HOSPITAL RESEARCH INSTITUTE (CA) 2025-07-17 WO disclosed