SCHEMBL10948113

SCHEMBL10948113

CCc1ccccc1NC(=O)C(Cl)=C(Cl)C(=O)O

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.54
HTT P42858 3/20 0.54
LMNA P02545 2/20 0.54
NPSR1 Q6W5P4 2/20 0.54
L3MBTL1 Q9Y468 1/20 0.54
NPC1 O15118 1/20 0.49
RAB9A P51151 1/20 0.49
CYP1A2 P05177 1/20 0.48
CYP3A4 P08684 1/20 0.48
CYP2D6 P10635 1/20 0.48
CYP2C9 P11712 1/20 0.48
CYP2C19 P33261 1/20 0.48
ALDH1A1 P00352 4/20 0.48
POLB P06746 2/20 0.48
GRIN2D O15399 1/20 0.48
GRIN3B O60391 1/20 0.48
GRIN1 Q05586 1/20 0.48
GRIN2A Q12879 1/20 0.48
GRIN2B Q13224 1/20 0.48
GRIN2C Q14957 1/20 0.48

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
SCHEMBL21551505 0.84 MAPT (0.60) MAPTHTTLMNANPSR1L3MBTL1
SCHEMBL5580657 0.83 MAPT (0.55) MAPTHTTLMNANPSR1L3MBTL1
SCHEMBL2349955 0.82 MAPT (0.61) MAPTHTTLMNANPSR1L3MBTL1
SCHEMBL11741381 0.79 MAPT (0.56) MAPTHTTLMNANPSR1L3MBTL1
SCHEMBL948318 0.79 MAPT (0.59) MAPTHTTLMNANPSR1L3MBTL1
SCHEMBL10951960 0.78 MAPT (0.55) MAPTHTTLMNANPSR1L3MBTL1
SCHEMBL10951505 0.77 MAPT (0.54) MAPTHTTLMNANPSR1L3MBTL1
SCHEMBL14398351 0.77 CYP2C19 (0.50) MAPTHTTLMNANPSR1L3MBTL1
SCHEMBL28557944 0.77 ALDH1A1 (0.58) MAPTHTTLMNANPSR1L3MBTL1
Hydrochloric Acid SCHEMBL22346017 0.77 MAPT (0.58) MAPTHTTLMNANPSR1L3MBTL1

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
US-4552890-A Plant phytopathogenic fungicidal agents based on maleimide BAYER AKTIENGESELLSCHAFT (DE) 1985-11-12 US claimed
US-4552890-A Plant phytopathogenic fungicidal agents based on maleimide BAYER AKTIENGESELLSCHAFT (DE) 1985-11-12 US disclosed