SCHEMBL1968753

SCHEMBL1968753

Cn1c(C(=O)O)cnc1-c1ccc(C(N)=O)cc1N(Cc1ccccc1)S(=O)(=O)c1ccccc1

nearest known ligand 0.46

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
TRPM8 Q7Z2W7 13/20 0.46
LMNA P02545 4/20 0.45
MEN1 O00255 1/20 0.45
KMT2A Q03164 1/20 0.45
ALDH1A1 P00352 2/20 0.43
KDM4E B2RXH2 1/20 0.43
HPGD P15428 1/20 0.43
HSD17B10 Q99714 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
HTT P42858 1/20 0.42
NPSR1 Q6W5P4 1/20 0.42
ACHE P22303 1/20 0.41

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
SCHEMBL1966566 0.83 LMNA (0.44) TRPM8LMNAMEN1KMT2AALDH1A1
SCHEMBL1963663 0.81 MAPT (0.45) LMNAMEN1KMT2AALDH1A1KDM4E
SCHEMBL302170 0.69 LMNA (0.53) LMNAMEN1KMT2AALDH1A1KDM4E
SCHEMBL1967123 0.68 LMNA (0.68) LMNAMEN1KMT2AALDH1A1HTT
SCHEMBL3379808 0.67 ALDH1A1 (0.52) LMNAMEN1KMT2AALDH1A1KDM4E
SCHEMBL17075503 0.67 MEN1 (0.60) LMNAMEN1KMT2AALDH1A1KDM4E
SCHEMBL3278663 0.64 PTGES (0.84) LMNAMEN1KMT2AALDH1A1KDM4E
SCHEMBL119485 0.64 TRPM8 (0.80) TRPM8
SCHEMBL120614 0.64 TRPM8 (1.00) TRPM8
SCHEMBL17075502 0.64 TAS2R14 (0.62) MEN1KMT2A

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-2334637-A1 NOVEL POTASSIUM CHANNEL BLOCKERS Xention Limited (GB) 2011-06-22 EP disclosed