SCHEMBL29098922

SCHEMBL29098922

CCCOc1ccc(Br)cc1OC(F)(F)F

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 4/20 0.50
KDM4E B2RXH2 3/20 0.44
SMN1; SMN2 Q16637 3/20 0.44
NPC1 O15118 2/20 0.44
LMNA P02545 2/20 0.44
RAB9A P51151 2/20 0.44
MAPT P10636 3/20 0.40
HSD17B10 Q99714 2/20 0.40
SLC6A4 P31645 2/20 0.39
MEN1 O00255 2/20 0.39
HTT P42858 2/20 0.39
KMT2A Q03164 2/20 0.39
ALDH1A1 P00352 2/20 0.39
USP2 O75604 1/20 0.39
TP53 P04637 1/20 0.39
POLB P06746 1/20 0.39
GAA P10253 1/20 0.39
CASP1 P29466 1/20 0.39
CASP7 P55210 1/20 0.39
ATM Q13315 1/20 0.39

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
SCHEMBL29098918 0.92 SMN1; SMN2 (0.45) HPGDKDM4ESMN1; SMN2NPC1LMNA
SCHEMBL29098920 0.89 SMN1; SMN2 (0.45) HPGDSMN1; SMN2NPC1LMNARAB9A
SCHEMBL3720178 0.87 HPGD (0.46) HPGDKDM4ESMN1; SMN2NPC1LMNA
SCHEMBL7928370 0.84 HPGD (0.60) HPGDKDM4ESMN1; SMN2NPC1LMNA
SCHEMBL4704298 0.80 MAPK1 (0.43) HPGDSMN1; SMN2LMNAMAPTSLC6A4
SCHEMBL14121850 0.80 SLC7A5 (0.38) KDM4ESMN1; SMN2LMNARAB9ASLC6A4
SCHEMBL7931152 0.80 HPGD (0.55) HPGDKDM4ESMN1; SMN2NPC1LMNA
SCHEMBL13010769 0.80 HPGD (0.55) HPGDKDM4ESMN1; SMN2NPC1LMNA
SCHEMBL18704596 0.79 S1PR4 (0.54) HPGDKDM4ESMN1; SMN2NPC1LMNA
SCHEMBL12144470 0.78 AAK1 (0.42) SLC6A4HRH4

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
CN-114230552-B Trifluoromethoxy dibenzothiophene, preparation method thereof and preparation method of related intermediate 江苏广域化学有限公司 2023-11-03 CN disclosed
CN-114230552-A Trifluoromethoxy dibenzothiophene, preparation method thereof and preparation method of related intermediate 江苏广域化学有限公司 2022-03-25 CN disclosed