SCHEMBL28820656

SCHEMBL28820656

C=CCn1c(S)nnc1-c1ccccc1OC

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 2/20 0.58
MAPT P10636 4/20 0.51
KDM4E B2RXH2 3/20 0.51
POLB P06746 2/20 0.51
ALOX15 P16050 2/20 0.51
ALPL P05186 1/20 0.51
ALPG P10696 1/20 0.51
RECQL P46063 1/20 0.51
LMNA P02545 4/20 0.49
HTT P42858 4/20 0.49
NPSR1 Q6W5P4 3/20 0.49
HCRTR1 O43613 1/20 0.48
TSHR P16473 3/20 0.45
L3MBTL1 Q9Y468 2/20 0.44
ALDH1A1 P00352 4/20 0.44
HPGD P15428 3/20 0.44
SMN1; SMN2 Q16637 2/20 0.44
KMT2A Q03164 3/20 0.44
NPC1 O15118 1/20 0.44
RAB9A P51151 1/20 0.44

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
SCHEMBL6404570 0.80 KMT2A (0.46) GAAMAPTKDM4EPOLBALOX15
SCHEMBL6406802 0.80 KMT2A (0.57) GAAKDM4EALOX15LMNAHTT
SCHEMBL6403768 0.76 ALDH1A1 (0.58) MAPTKDM4EALOX15LMNAHTT
SCHEMBL6406974 0.75 KMT2A (0.63) GAAKDM4EALOX15LMNATSHR
SCHEMBL13401049 0.75 L3MBTL1 (0.55) MAPTKDM4EALPLALPGRECQL
SCHEMBL29076118 0.75 KDM4E (0.70) GAAMAPTKDM4EPOLBLMNA
SCHEMBL30581245 0.75 KDM4E (0.70) GAAMAPTKDM4EPOLBLMNA
SCHEMBL2889816 0.74 KDM4E (0.52) KDM4EALOX15LMNATSHRALDH1A1
SCHEMBL6406516 0.73 ALDH1A1 (0.43) GAAMAPTKDM4EPOLBALOX15
SCHEMBL12110607 0.71 ALDH1A1 (0.55) KDM4EALOX15LMNAHTTTSHR

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-114907514-A Multifunctional fiber and preparation method and application thereof 北京洁尔爽高科技有限公司 2022-08-16 CN disclosed