SCHEMBL28640770

SCHEMBL28640770

c1ccc([Si](c2ccccc2)(c2ccccc2)c2ccc(Sc3ccc([Si](c4ccccc4)(c4ccccc4)c4ccccc4)cc3)cc2)cc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOA P21397 3/20 0.43
MAOB P27338 3/20 0.43
HPGD P15428 4/20 0.40
ALDH1A1 P00352 2/20 0.40
CHRNA7 P36544 1/20 0.38
NR1H2 P55055 1/20 0.38
DDAH1 O94760 1/20 0.38
NOS1 P29475 1/20 0.38
CYP3A4 P08684 1/20 0.38
TSHR P16473 1/20 0.38
MAPK1 P28482 1/20 0.38
BCL2 P10415 1/20 0.37
MCL1 Q07820 1/20 0.37
SLC6A4 P31645 1/20 0.36
KDM1A O60341 1/20 0.35
MAPT P10636 3/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
MGLL Q99685 1/20 0.35
HSD17B10 Q99714 1/20 0.35
ESR1 P03372 1/20 0.34

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
SCHEMBL14216508 0.97 MAOA (0.46) MAOAMAOBHPGDALDH1A1CHRNA7
SCHEMBL15975758 0.83 ESR1 (0.43) HPGDALDH1A1NR1H2TSHRMAPK1
SCHEMBL103830 0.83 ESR1 (0.43) HPGDALDH1A1NR1H2TSHRMAPK1
SCHEMBL126319 0.83 ESR1 (0.43) HPGDALDH1A1NR1H2TSHRMAPK1
SCHEMBL15975757 0.83 ESR1 (0.43) HPGDALDH1A1NR1H2TSHRMAPK1
SCHEMBL12879524 0.83 ESR1 (0.43) HPGDALDH1A1NR1H2TSHRMAPK1
SCHEMBL20955833 0.80 AR (0.43) ALDH1A1CYP3A4SLC6A4MAPTSMN1; SMN2
SCHEMBL464991 0.80 ALDH1A1 (0.40) HPGDALDH1A1TSHRMAPK1MAPT
SCHEMBL23277364 0.76 MAOA (0.62) MAOAMAOBHPGDALDH1A1CHRNA7
SCHEMBL3891151 0.76 MAOA (0.62) MAOAMAOBHPGDALDH1A1CHRNA7

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-108884110-B Sulfonium salt, photoacid generator, photocurable composition, and cured product thereof 三亚普罗股份有限公司 2021-09-14 CN disclosed