SCHEMBL20428786

SCHEMBL20428786

c1csc(-c2ccc(-c3ccc(-c4ccc(-c5ccc(-c6cccs6)s5)c5nsnc45)c4nsnc34)s2)c1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 4/20 0.45
LTA4H P09960 1/20 0.42
ALDH1A1 P00352 7/20 0.40
KDM4E B2RXH2 7/20 0.40
L3MBTL1 Q9Y468 5/20 0.40
GAA P10253 3/20 0.40
MAPT P10636 3/20 0.40
LMNA P02545 2/20 0.40
GLA P06280 2/20 0.40
NPC1 O15118 4/20 0.39
RAB9A P51151 4/20 0.39
MEN1 O00255 3/20 0.39
HPGD P15428 3/20 0.39
KMT2A Q03164 3/20 0.39
HSD17B10 Q99714 3/20 0.39
POLB P06746 2/20 0.39
CASP1 P29466 2/20 0.39
CASP7 P55210 2/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
TP53 P04637 1/20 0.39

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
SCHEMBL14685994 0.98 DPP4 (0.46) DPP4LTA4HALDH1A1KDM4EL3MBTL1
SCHEMBL20610387 0.97 DPP4 (0.45) DPP4LTA4HALDH1A1KDM4EL3MBTL1
SCHEMBL12587621 0.93 DPP4 (0.40) DPP4LTA4HALDH1A1KDM4EL3MBTL1
SCHEMBL15446989 0.89 DPP4 (0.40) DPP4LTA4HALDH1A1KDM4EL3MBTL1
SCHEMBL41299 0.85 KDM4E (0.43) LTA4HALDH1A1KDM4EL3MBTL1MAPT
SCHEMBL23521570 0.84 KDM4E (0.41) DPP4LTA4HALDH1A1KDM4EL3MBTL1
SCHEMBL10330347 0.83 ALDH1A1 (0.36) LTA4HALDH1A1KDM4EL3MBTL1GAA
SCHEMBL4755025 0.82 RAB9A (0.35) DPP4LTA4HALDH1A1KDM4EL3MBTL1
SCHEMBL15446966 0.82 TDO2 (0.34) DPP4LTA4HALDH1A1KDM4EL3MBTL1
SCHEMBL26500112 0.82 DHODH (0.34) DPP4LTA4HALDH1A1KDM4EL3MBTL1

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
EP-2562197-B1 COPOLYMER COMPRISING ANTHRACENE AND BENZOSELENADIAZOLE, PREPARING METHOD AND USES THEREOF OCEANS KING LIGHTING SCI & TEC (CN) 2018-08-01 EP disclosed