SCHEMBL7580832

SCHEMBL7580832

Cc1ccc(C2=CC(=O)N(Nc3ccc(Cl)cc3)C2=O)cc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 1.00
NPSR1 Q6W5P4 4/20 1.00
LMNA P02545 4/20 1.00
CACNA1B Q00975 3/20 1.00
APBA1 Q02410 3/20 1.00
TDP1 Q9NUW8 1/20 1.00
ALDH1A1 P00352 3/20 0.74
HPGD P15428 3/20 0.74
ALOX12 P18054 2/20 0.74
GAA P10253 2/20 0.74
CCR6 P51684 2/20 0.74
HCRTR1 O43613 1/20 0.74
S1PR4 O95977 1/20 0.74
HSP90AA1 P07900 1/20 0.74
S1PR1 P21453 1/20 0.74
HTT P42858 1/20 0.74
RGS4 P49798 1/20 0.45
CNR1 P21554 2/20 0.40
TP53 P04637 1/20 0.39
NPC1 O15118 1/20 0.37

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
SCHEMBL7582309 1.00 MAPT (1.00) MAPTNPSR1LMNACACNA1BAPBA1
SCHEMBL7582161 0.93 MAPT (0.86) MAPTNPSR1LMNACACNA1BAPBA1
SCHEMBL7580794 0.88 MAPT (0.79) MAPTNPSR1LMNACACNA1BAPBA1
SCHEMBL7582395 0.86 MAPT (0.75) MAPTNPSR1LMNACACNA1BAPBA1
SCHEMBL7582505 0.85 MAPT (1.00) MAPTNPSR1LMNACACNA1BAPBA1
SCHEMBL7580750 0.85 MAPT (1.00) MAPTNPSR1LMNACACNA1BAPBA1
SCHEMBL7580868 0.85 MAPT (0.89) MAPTNPSR1LMNACACNA1BAPBA1
SCHEMBL7589474 0.85 MAPT (0.76) MAPTNPSR1LMNACACNA1BAPBA1
SCHEMBL7584263 0.82 MAPT (0.69) MAPTNPSR1LMNACACNA1BAPBA1
SCHEMBL7582617 0.77 MAPT (0.86) MAPTNPSR1LMNACACNA1BAPBA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6476061-B1 Fungicides containing pyrrolidones as their active agents BASF AKTIENGESELLSCHAFT (DE) 2002-11-05 US claimed
EP-1133229-B1 FUNGICIDES CONTAINING PYRROLIDONES AS THEIR ACTIVE AGENTS BASF AG (DE) 2002-10-09 EP claimed
US-6476061-B1 Fungicides containing pyrrolidones as their active agents BASF AKTIENGESELLSCHAFT (DE) 2002-11-05 US disclosed
EP-1133229-B1 FUNGICIDES CONTAINING PYRROLIDONES AS THEIR ACTIVE AGENTS BASF AG (DE) 2002-10-09 EP disclosed