SCHEMBL25812743

SCHEMBL25812743

Cc1cc2ccc3sc4ccccc4c3c2c2c1sc1ccccc12

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 7/20 0.42
ALDH1A1 P00352 7/20 0.42
L3MBTL1 Q9Y468 4/20 0.42
POLB P06746 3/20 0.42
HCRTR1 O43613 2/20 0.42
LMNA P02545 1/20 0.42
GPR3 P46089 1/20 0.39
MEN1 O00255 3/20 0.38
KMT2A Q03164 3/20 0.38
GAA P10253 1/20 0.38
ATM Q13315 1/20 0.38
TDP1 Q9NUW8 2/20 0.36
DUSP3 P51452 1/20 0.36
BLM P54132 1/20 0.36
PTPN5 P54829 1/20 0.36
PTPN11 Q06124 1/20 0.36
MCL1 Q07820 1/20 0.36
CTDSP1 Q9GZU7 1/20 0.36
TNKS O95271 1/20 0.36
TNKS2 Q9H2K2 1/20 0.36

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
SCHEMBL18810714 0.84 ALDH1A1 (0.42) MAPTALDH1A1L3MBTL1POLBHCRTR1
SCHEMBL24172204 0.82 MAPT (0.40) MAPTALDH1A1L3MBTL1POLBHCRTR1
SCHEMBL22013005 0.82 MAPT (0.39) MAPTALDH1A1L3MBTL1POLBHCRTR1
SCHEMBL22011437 0.81 GPR3 (0.39) MAPTALDH1A1L3MBTL1POLBHCRTR1
SCHEMBL24614734 0.81 PTPN1 (0.42) MAPTALDH1A1L3MBTL1POLBHCRTR1
SCHEMBL24614711 0.81 MAPT (0.35) MAPTALDH1A1L3MBTL1POLBHCRTR1
SCHEMBL24172203 0.81 MAPT (0.36) MAPTALDH1A1L3MBTL1POLBHCRTR1
SCHEMBL25813282 0.81 L3MBTL1 (0.42) MAPTALDH1A1L3MBTL1POLBHCRTR1
SCHEMBL16283926 0.80 ALDH1A1 (0.46) MAPTALDH1A1L3MBTL1POLBHCRTR1
SCHEMBL24614819 0.80 MAPT (0.41) MAPTALDH1A1L3MBTL1POLBHCRTR1

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-3880682-B1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES MERCK PATENT GMBH (DE) 2023-06-14 EP disclosed