SCHEMBL25028293

SCHEMBL25028293

Clc1ccc(-c2nc3cc4sc(-c5ccc(Cl)cc5)nc4cc3s2)cc1

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
APP P05067 9/20 0.61
MAPT P10636 6/20 0.53
KDM4E B2RXH2 4/20 0.53
NPC1 O15118 4/20 0.53
GAA P10253 4/20 0.53
RAB9A P51151 4/20 0.53
ALDH1A1 P00352 3/20 0.53
KMT2A Q03164 3/20 0.53
MEN1 O00255 2/20 0.53
POLB P06746 2/20 0.53
GLA P06280 2/20 0.53
NFKB1 P19838 1/20 0.53
GFER P55789 1/20 0.53
NFKB2 Q00653 1/20 0.53
RELA Q04206 1/20 0.53
SMN1; SMN2 Q16637 3/20 0.51
PKM P14618 1/20 0.51
HPGD P15428 1/20 0.51
HTT P42858 1/20 0.51
ATM Q13315 1/20 0.51

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
SCHEMBL10424579 0.89 MAPT (0.62) APPMAPTKDM4ENPC1GAA
SCHEMBL11201951 0.83 MAPT (0.60) APPMAPTKDM4ENPC1GAA
SCHEMBL3193978 0.83 MAPT (0.81) APPMAPTKDM4ENPC1GAA
SCHEMBL28015125 0.83 MAPT (0.53) APPMAPTKDM4ENPC1GAA
SCHEMBL2244906 0.83 MAPT (0.81) APPMAPTKDM4ENPC1GAA
SCHEMBL12355589 0.83 MAPT (0.72) APPMAPTKDM4ENPC1GAA
SCHEMBL2090469 0.83 MAPT (0.53) APPMAPTKDM4ENPC1GAA
SCHEMBL30727497 0.81 APP (0.62) APPMAPTKDM4ENPC1GAA
SCHEMBL3007676 0.81 RAB9A (0.69) APPMAPTKDM4ENPC1GAA
SCHEMBL14205633 0.80 APP (0.65) APPMAPTKDM4ENPC1GAA

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