SCHEMBL17429334

SCHEMBL17429334

N#COS(=O)(=O)Cc1ccc(F)cc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA12 O43570 3/20 0.38
CA2 P00918 3/20 0.38
CA7 P43166 2/20 0.38
CA9 Q16790 2/20 0.38
CA14 Q9ULX7 1/20 0.38
KMT2A Q03164 2/20 0.38
MIF P14174 1/20 0.36
TXNRD1 Q16881 1/20 0.36
CA1 P00915 2/20 0.36
IDO1 P14902 3/20 0.35
AGXT P21549 2/20 0.35
ALDH1A1 P00352 1/20 0.35
MGMT P16455 1/20 0.35
YAP1 P46937 1/20 0.35
TEAD4 Q15561 1/20 0.35
TEAD2 Q15562 1/20 0.35
LOXL2 Q9Y4K0 1/20 0.34
MAOA P21397 1/20 0.34
MAOB P27338 1/20 0.34
MAPT P10636 1/20 0.34

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
SCHEMBL17429348 0.82 KIF11 (0.51) CA2CA9KMT2AMIFCA1
SCHEMBL17429328 0.81 POLB (0.43) CA2CA9KMT2ATXNRD1CA1
SCHEMBL10405155 0.81 KMT2A (0.55) CA2CA9KMT2ACA1ALDH1A1
SCHEMBL17429351 0.75 KMT2A (0.44) CA12CA2CA7CA9KMT2A
SCHEMBL28771805 0.75 TXNRD1 (0.44) CA12CA2CA7CA9CA14
SCHEMBL8968526 0.75 IDO1 (0.48) CA12CA2CA7CA9KMT2A
SCHEMBL8968029 0.73 IDO1 (0.47) CA12CA2CA7CA9KMT2A
SCHEMBL27549032 0.72 YAP1 (0.41) CA12CA2CA7CA9KMT2A
SCHEMBL17429321 0.71 MEN1 (0.43) CA2KMT2ACA1ALDH1A1MAOA
SCHEMBL422010 0.71 USP2 (0.51) CA12CA2CA7CA9KMT2A

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-9947965-B2 Nonaqueous electrolyte solution and nonaqueous electrolyte battery using same MITSUBISHI CHEMICAL CORPORATION (JP) 2018-04-17 US disclosed
US-20160013517-A1 NONAQUEOUS ELECTROLYTE SOLUTION AND NONAQUEOUS ELECTROLYTE BATTERY USING SAME MITSUBISHI CHEMICAL CORPORATION (JP) 2016-01-14 US disclosed