SCHEMBL11410074

SCHEMBL11410074

CS(=O)(=O)c1ccccc1N=Cc1cccc(F)c1F

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 1/20 0.42
PBRM1 Q86U86 2/20 0.36
SPHK2 Q9NRA0 1/20 0.36
SPHK1 Q9NYA1 1/20 0.36
CA2 P00918 4/20 0.36
CA9 Q16790 4/20 0.36
CA12 O43570 2/20 0.36
MAPT P10636 3/20 0.35
CA1 P00915 3/20 0.35
CA7 P43166 2/20 0.35
POLB P06746 2/20 0.35
ALDH1A1 P00352 2/20 0.35
L3MBTL1 Q9Y468 2/20 0.35
KDM4E B2RXH2 1/20 0.35
MPI P34949 1/20 0.35
RECQL P46063 1/20 0.35
LMNA P02545 3/20 0.35
HTT P42858 3/20 0.35
GAA P10253 2/20 0.35
NPSR1 Q6W5P4 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
SCHEMBL11413647 0.80 CA12 (0.46) PBRM1CA2CA9CA12MAPT
SCHEMBL11413649 0.80 CA12 (0.46) PBRM1CA2CA9CA12MAPT
SCHEMBL11414965 0.77 CA12 (0.38) PTGS2PBRM1CA2CA9CA12
SCHEMBL11410987 0.73 CA2 (0.47) PTGS2CA2CA9CA12MAPT
SCHEMBL11411127 0.73 SIRT2 (0.46) PTGS2CA2CA9MAPTCA1
SCHEMBL11411120 0.73 SIRT2 (0.46) PTGS2CA2CA9MAPTCA1
SCHEMBL11415876 0.73 MAPT (0.53) SPHK2SPHK1CA2CA9CA12
SCHEMBL11415897 0.73 MAPT (0.53) SPHK2SPHK1CA2CA9CA12
SCHEMBL11406095 0.72 PTGS2 (0.50) PTGS2PBRM1CA2CA9CA12
SCHEMBL11406096 0.72 PTGS2 (0.50) PTGS2PBRM1CA2CA9CA12

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-4230727-A N-BENZYLIDENEANILINE AND DERIVATIVES WILLIAM H. RORER, INC. (US) 1980-10-28 US disclosed
US-4187317-A Sunscreen and erythema treating with N-benzylidene anilenes WILLIAM H. RORER, INC. (US) 1980-02-05 US disclosed