SCHEMBL353442

SCHEMBL353442

CN(C(=O)c1ccc(Cl)nc1)c1nsc2cccc(CC(F)F)c12

nearest known ligand 0.36

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.36
POLB P06746 1/20 0.34
PKM P14618 1/20 0.34
KMT2A Q03164 5/20 0.33
MEN1 O00255 3/20 0.33
SMN1; SMN2 Q16637 3/20 0.33
ALDH1A1 P00352 3/20 0.33
L3MBTL1 Q9Y468 2/20 0.33
MAPT P10636 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
NAPRT Q6XQN6 1/20 0.33
RAB9A P51151 3/20 0.32
NPC1 O15118 1/20 0.32
MDM2 Q00987 1/20 0.32
HCRTR1 O43613 1/20 0.31
HCRTR2 O43614 1/20 0.31
GRM4 Q14833 1/20 0.31

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
SCHEMBL353355 0.89 KMT2A (0.36) LMNAPOLBPKMKMT2AMEN1
SCHEMBL351633 0.83 KMT2A (0.40) LMNAPOLBPKMKMT2AMEN1
SCHEMBL10167555 0.82 KCNQ3 (0.36) POLBPKMKMT2AMEN1SMN1; SMN2
SCHEMBL10167578 0.80 L3MBTL1 (0.42) LMNAPOLBPKMKMT2AMEN1
SCHEMBL352691 0.78 KMT2A (0.39) LMNAPOLBPKMKMT2AMEN1
SCHEMBL357050 0.75 KDM4E (0.34) KMT2AMEN1SMN1; SMN2ALDH1A1MAPT
SCHEMBL10167556 0.72 KMT2A (0.35) LMNAPOLBPKMKMT2AMEN1
SCHEMBL353134 0.72 HCRTR1 (0.39) KMT2AMEN1ALDH1A1HCRTR1HCRTR2
SCHEMBL358113 0.72 KMT2A (0.40) LMNAPOLBPKMKMT2AMEN1
SCHEMBL352456 0.71 HCRTR1 (0.39) KMT2AMEN1ALDH1A1MAPTRAB9A

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-2064196-B1 3-AMINO-1,2-BENZISOTHIAZOLE COMPOUNDS FOR COMBATING ANIMAL PEST II BASF SE (DE) 2012-03-14 EP disclosed