SCHEMBL25028201

SCHEMBL25028201

COc1ccc(-c2nc3sc(-c4ccc(-c5cccs5)s4)nc3s2)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 8/20 0.50
NPC1 O15118 7/20 0.50
RAB9A P51151 7/20 0.50
PKM P14618 3/20 0.50
KDM4E B2RXH2 3/20 0.50
PDE10A Q9Y233 1/20 0.48
APP P05067 1/20 0.46
SMN1; SMN2 Q16637 4/20 0.46
DPP4 P27487 1/20 0.43
ALDH1A1 P00352 4/20 0.43
HPGD P15428 3/20 0.43
L3MBTL1 Q9Y468 2/20 0.43
LMNA P02545 1/20 0.43
MAPK1 P28482 1/20 0.43
ATM Q13315 1/20 0.43
ALOX5 P09917 2/20 0.43
TDP1 Q9NUW8 1/20 0.43
MEN1 O00255 2/20 0.42
KMT2A Q03164 2/20 0.42
CYP1A2 P05177 1/20 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
SCHEMBL25027897 0.86 KDM4E (0.53) MAPTNPC1RAB9APKMKDM4E
SCHEMBL23954384 0.86 ALDH1A1 (0.46) MAPTNPC1RAB9AKDM4ESMN1; SMN2
SCHEMBL10301435 0.84 DPP4 (0.49) MAPTNPC1RAB9AKDM4ESMN1; SMN2
SCHEMBL25028183 0.84 DPP4 (0.49) MAPTNPC1RAB9AKDM4ESMN1; SMN2
SCHEMBL12393767 0.82 APP (0.69) MAPTNPC1RAB9APKMKDM4E
SCHEMBL13801084 0.79 KDM4E (0.61) MAPTNPC1RAB9APKMKDM4E
SCHEMBL27671498 0.76 RAB9A (0.50) MAPTNPC1RAB9APKMKDM4E
SCHEMBL23951 0.74 MAPT (0.59) MAPTNPC1RAB9APKMKDM4E
SCHEMBL2375004 0.74 KDM4E (0.58) MAPTNPC1RAB9AKDM4EALDH1A1
SCHEMBL29173072 0.72 MAPT (0.58) MAPTNPC1RAB9APKMKDM4E

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
US-20230050869-A1 THERMOELECTRIC CONVERSION MATERIAL, AND THERMOELECTRIC CONVERSION ELEMENT PREPARED THEREWITH TOYO INK SC HOLDINGS CO., LTD. (JP) 2023-02-16 US disclosed