SCHEMBL22689593

SCHEMBL22689593

CCCCCCc1ccc2sc(NS)nc2c1CCCCCC

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.36
TYR P14679 2/20 0.36
MEN1 O00255 2/20 0.36
KMT2A Q03164 2/20 0.36
TDP1 Q9NUW8 2/20 0.36
CYP3A4 P08684 2/20 0.36
TP53 P04637 1/20 0.36
ALOX5 P09917 1/20 0.36
ALOX15 P16050 1/20 0.36
TSHR P16473 1/20 0.36
HTT P42858 1/20 0.36
BCHE P06276 2/20 0.35
GRIN2B Q13224 2/20 0.35
NPC1 O15118 1/20 0.35
PTGS2 P35354 1/20 0.34
GAA P10253 3/20 0.34
ALDH1A1 P00352 3/20 0.33
KDM4E B2RXH2 2/20 0.33
KCNH2 Q12809 1/20 0.33
PKM P14618 1/20 0.33

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
SCHEMBL22689503 1.00 MAPT (0.36) MAPTTYRMEN1KMT2ATDP1
SCHEMBL23456997 1.00 MAPT (0.36) MAPTTYRMEN1KMT2ATDP1
SCHEMBL22689600 1.00 MAPT (0.36) MAPTTYRMEN1KMT2ATDP1
SCHEMBL22689640 1.00 MAPT (0.36) MAPTTYRMEN1KMT2ATDP1
SCHEMBL23457015 1.00 MAPT (0.36) MAPTTYRMEN1KMT2ATDP1
SCHEMBL22981635 0.99 NPC1 (0.36) MAPTTYRMEN1KMT2ATDP1
SCHEMBL22689594 0.95 NPC1 (0.36) MAPTTYRMEN1KMT2ATDP1
SCHEMBL22689639 0.86 MEN1 (0.36) MAPTMEN1KMT2ATDP1NPC1
SCHEMBL23175124 0.77 MEN1 (0.40) MAPTMEN1KMT2ATDP1HTT
SCHEMBL4539621 0.76 TYR (0.36) MAPTTYRMEN1KMT2ATDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2021066099-A1 RUN-FLAT TIRE 株式会社ブリヂストン 2021-04-08 WO disclosed
WO-2021066106-A1 RUBBER COMPOSITION AND RUN-FLAT TIRE 株式会社ブリヂストン 2021-04-08 WO disclosed
WO-2020235230-A1 RUBBER COMPOSITION, RUBBER COMPOSITION FOR TIRE, AND TIRE 株式会社ブリヂストン (JP) 2020-11-26 WO disclosed