SCHEMBL28026979

SCHEMBL28026979

[Zn].c1cc2c(cnc3ccsc32)s1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.55
ALDH1A1 P00352 2/20 0.55
MAPT P10636 2/20 0.55
HTT P42858 2/20 0.55
HPGD P15428 1/20 0.55
PPARG P37231 1/20 0.55
NCOA2 Q15596 1/20 0.55
NCOA1 Q15788 1/20 0.55
TDP1 Q9NUW8 1/20 0.55
NCOA3 Q9Y6Q9 1/20 0.55
LMNA P02545 1/20 0.44
AXL P30530 1/20 0.41
MKNK1 Q9BUB5 1/20 0.41
MKNK2 Q9HBH9 1/20 0.41
PDPK1 O15530 1/20 0.39
PARP1 P09874 1/20 0.39
DYRK1A Q13627 1/20 0.38
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34
HTR2C P28335 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
SCHEMBL377324 0.98 KDM4E (0.56) KDM4EALDH1A1MAPTHTTHPGD
SCHEMBL30662086 0.72 KDM4E (0.59) KDM4EALDH1A1MAPTHTTHPGD
SCHEMBL3277153 0.71 KDM4E (0.53) KDM4EALDH1A1MAPTHPGDLMNA
SCHEMBL29865427 0.69 KDM4E (0.56) KDM4EALDH1A1MAPTHTTHPGD
SCHEMBL29865416 0.69 KDM4E (0.56) KDM4EALDH1A1MAPTHTTHPGD
SCHEMBL8570253 0.68 AXL (0.45) KDM4EALDH1A1MAPTHTTHPGD
SCHEMBL29866074 0.68 LMNA (0.57) KDM4EALDH1A1MAPTHTTHPGD
SCHEMBL2550475 0.67 KDM4E (0.53) KDM4EALDH1A1MAPTHTTHPGD
SCHEMBL14498848 0.65 KDM4E (0.53) KDM4EALDH1A1MAPTHTTHPGD
SCHEMBL10768234 0.65 AXL (0.42) KDM4EALDH1A1MAPTHTTHPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-105176518-A Double-thienopyridine zinc complex luminescent material and preparation method thereof BEIJING INST TECHNOLOGY 2015-12-23 CN disclosed
CN-105176518-A Double-thienopyridine zinc complex luminescent material and preparation method thereof BEIJING INST TECHNOLOGY 2015-12-23 CN disclosed