SCHEMBL22945928

SCHEMBL22945928

CCc1c(Cl)ccc(C(=O)c2c(C)nn(C)c2O)c1Cl

nearest known ligand 0.36

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 2/20 0.36
CNR2 P34972 2/20 0.36
MAPT P10636 3/20 0.34
KDM4E B2RXH2 3/20 0.34
ALDH1A1 P00352 1/20 0.34
SMN1; SMN2 Q16637 4/20 0.33
NR2F2 P24468 2/20 0.33
KMT2A Q03164 2/20 0.33
HTT P42858 1/20 0.33
MEN1 O00255 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
LMNA P02545 2/20 0.33
RAB9A P51151 2/20 0.33
GALR3 O60755 1/20 0.33
PDE4B Q07343 1/20 0.32
RORC P51449 1/20 0.32
NR3C1 P04150 2/20 0.32
NPC1 O15118 1/20 0.32

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
SCHEMBL23061315 0.85 ALDH1A1 (0.31) MAPTKDM4EALDH1A1SMN1; SMN2NR2F2
SCHEMBL10680900 0.84 MAPT (0.36) CNR1CNR2MAPTKDM4EALDH1A1
SCHEMBL22945927 0.82 RORC (0.32) CNR1CNR2RORC
SCHEMBL22946153 0.82 RORC (0.43) CNR1CNR2ALDH1A1SMN1; SMN2KMT2A
SCHEMBL22946159 0.82 GAA (0.35) ALDH1A1SMN1; SMN2L3MBTL1LMNARAB9A
SCHEMBL23061052 0.81 GPBAR1 (0.36) RORC
SCHEMBL22945898 0.81 KMT2A (0.38) MAPTKDM4EALDH1A1KMT2AMEN1
SCHEMBL23061064 0.81 RORC (0.34) ALDH1A1L3MBTL1RORCNR3C1
SCHEMBL23061068 0.81 ALDH1A1 (0.33) ALDH1A1L3MBTL1LMNARORC
SCHEMBL22946323 0.81 KDM4E (0.40) KDM4EALDH1A1SMN1; SMN2KMT2AHTT

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2021036845-A1 SUBSTITUTED BENZOYL COMPOUND AND APPLICATION THEREOF 东莞市东阳光农药研发有限公司 2021-03-04 WO disclosed
WO-2021018135-A1 HETEROCYCLYL ALKYL SUBSTITUTED DICHLOROBENZOYL COMPOUNDS AND APPLICATIONS THEREOF 东莞市东阳光农药研发有限公司 2021-02-04 WO disclosed