SCHEMBL5548671

SCHEMBL5548671

O=C1c2ccc(S)cc2C(=O)c2ccc(S)cc21

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOA P21397 2/20 0.50
MAOB P27338 2/20 0.50
ESR1 P03372 1/20 0.50
UGT1A1 P22309 1/20 0.50
ESR2 Q92731 1/20 0.50
NPC1 O15118 4/20 0.44
ALDH1A1 P00352 4/20 0.44
RAB9A P51151 4/20 0.44
SMN1; SMN2 Q16637 3/20 0.44
MAPK1 P28482 2/20 0.44
ELANE P08246 1/20 0.44
TP53 P04637 1/20 0.44
CYP3A4 P08684 1/20 0.44
TSHR P16473 1/20 0.44
TDP1 Q9NUW8 1/20 0.44
MEN1 O00255 2/20 0.43
KMT2A Q03164 2/20 0.43
CDC25B P30305 1/20 0.43
BCL2 P10415 2/20 0.42
MCL1 Q07820 2/20 0.42

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
SCHEMBL5159657 0.93 MEN1 (0.57) MAOAMAOBESR1UGT1A1ESR2
SCHEMBL17493301 0.91 MEN1 (0.55) MAOAMAOBESR1UGT1A1ESR2
SCHEMBL26205089 0.87 MAOA (0.40) MAOAMAOBESR1UGT1A1ESR2
SCHEMBL26205093 0.77 ESR1 (0.34) MAOAMAOBESR1UGT1A1ESR2
SCHEMBL25826040 0.77 CASP3 (0.54) CYP3A4TDP1CASP3
Methane SCHEMBL9862054 0.76 ADORA2A (0.66) MAOAMAOBNPC1ALDH1A1RAB9A
SCHEMBL16601828 0.75 NPC1 (0.60) MAOAMAOBNPC1ALDH1A1RAB9A
SCHEMBL10705698 0.72 TDP1 (0.52) ALDH1A1MAPK1TSHRTDP1L3MBTL1
SCHEMBL14389386 0.72 PPOX (0.56) MAOAMAOBALDH1A1CYP3A4TDP1
SCHEMBL16601666 0.70 MEN1 (0.61) MAOAMAOBNPC1ALDH1A1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230213863-A1 COMPOUND, RESIST UNDERLAYER FILM COMPOSITION INCLUDING SAME, AND RESIST UNDERLAYER FILM DONGJIN SEMICHEM CO., LTD. (KR) 2023-07-06 US disclosed
US-20230213863-A1 COMPOUND, RESIST UNDERLAYER FILM COMPOSITION INCLUDING SAME, AND RESIST UNDERLAYER FILM DONGJIN SEMICHEM CO., LTD. (KR) 2023-07-06 US disclosed
US-20190322558-A1 Microbial Electrochemical Cell and direct salt recovery GOEL APOORVA (AE) 2019-10-24 US disclosed
US-9701629-B2 Use of dithiocarbamate esters and bis-dithiocarbamate esters in the preparation of organic-inorganic nanocomposites SONY DEUTSCHLAND GMBH (DE) 2017-07-11 US disclosed
US-9701629-B2 Use of dithiocarbamate esters and bis-dithiocarbamate esters in the preparation of organic-inorganic nanocomposites SONY DEUTSCHLAND GMBH (DE) 2017-07-11 US disclosed
US-RE44510-E1 Multifunctional linker molecules for tuning electronic charge transport through organic-inorganic composite structures and uses thereof SONY DEUTSCHLAND GMBH (DE) 2013-09-24 US disclosed
US-RE44510-E1 Multifunctional linker molecules for tuning electronic charge transport through organic-inorganic composite structures and uses thereof SONY DEUTSCHLAND GMBH (DE) 2013-09-24 US disclosed
US-8173842-B2 Multifunctional linker molecules for tuning electronic charge transport through organic-inorganic composite structures and uses thereof SONY DEUTSCHLAND GMBH (DE) 2012-05-08 US disclosed
US-7923576-B2 Multifunctional linker molecules for tuning electronic charge transport through organic-inorganic composite structures and uses thereof SONY DEUTSCHLAND GMBH (DE) 2011-04-12 US disclosed
US-7923576-B2 Multifunctional linker molecules for tuning electronic charge transport through organic-inorganic composite structures and uses thereof SONY DEUTSCHLAND GMBH (DE) 2011-04-12 US disclosed