SCHEMBL29045210

SCHEMBL29045210

CCCCn1c2ccccc2c2cccc(NNC)c21

nearest known ligand 0.55

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PGR P06401 6/20 0.55
RORA P35398 5/20 0.55
RORC P51449 5/20 0.55
RORB Q92753 5/20 0.55
TDP1 Q9NUW8 1/20 0.45
L3MBTL1 Q9Y468 1/20 0.45
KDM4E B2RXH2 3/20 0.44
HPGD P15428 3/20 0.44
ALDH1A1 P00352 3/20 0.44
MEN1 O00255 3/20 0.41
KMT2A Q03164 3/20 0.41
LMNA P02545 2/20 0.41
CNR2 P34972 2/20 0.41
NPC1 O15118 2/20 0.41
CNR1 P21554 1/20 0.41
TP53 P04637 1/20 0.41
HTT P42858 1/20 0.41

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
SCHEMBL29045202 0.92 POLB (0.44) PGRRORARORCRORBTDP1
SCHEMBL27967408 0.80 PGR (0.56) PGRRORARORCRORBTDP1
SCHEMBL29531665 0.77 PGR (0.73) PGRRORARORCRORBTDP1
SCHEMBL1335135 0.77 PGR (0.73) PGRRORARORCRORBTDP1
SCHEMBL15667726 0.76 PGR (0.58) PGRRORARORCRORBKDM4E
SCHEMBL27879273 0.75 PGR (0.51) PGRRORARORCRORBKDM4E
SCHEMBL19978658 0.75 PGR (0.48) PGRRORARORCRORBTDP1
SCHEMBL27853413 0.74 CNR2 (0.50) PGRRORARORCRORBKDM4E
SCHEMBL27967271 0.74 CNR2 (0.50) PGRRORARORCRORBKDM4E
SCHEMBL28003764 0.74 CNR2 (0.50) PGRRORARORCRORBKDM4E

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
CN-116478082-A Synthesis method of carbazolyl-containing Schiff base in eutectic solvent 陕西科技大学 2023-07-25 CN disclosed