SCHEMBL328643

SCHEMBL328643

CN(C)c1ccc2ccc(S(=O)(=O)N(C)CCN(CC(N)=O)S(=O)(=O)c3cc(F)c(Oc4ccc(Cl)cc4)c(F)c3)cc2c1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.35
NR2F2 P24468 1/20 0.34
RAB9A P51151 1/20 0.34
DAGLA Q9Y4D2 3/20 0.34
PGR P06401 1/20 0.33
PDE4D Q08499 1/20 0.33
MAPT P10636 4/20 0.33
POLB P06746 1/20 0.33
MEN1 O00255 2/20 0.32
CYSLTR1 Q9Y271 1/20 0.32
CYP3A4 P08684 1/20 0.32
CYP2C19 P33261 1/20 0.32
F10 P00742 1/20 0.32
STAT3 P40763 1/20 0.32
TP53 P04637 1/20 0.32
CASP6 P55212 1/20 0.32
ALDH1A1 P00352 1/20 0.31
LMNA P02545 1/20 0.31
HTT P42858 1/20 0.31
HCRTR1 O43613 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
SCHEMBL328661 0.86 KMT2A (0.38) KMT2ARAB9ADAGLAPOLBCYP3A4
SCHEMBL6851659 0.86 CSF1R (0.33) KMT2ADAGLAPGRPOLBMEN1
SCHEMBL328414 0.84 DAGLA (0.37) KMT2ADAGLAPGRPOLBCYP3A4
SCHEMBL328548 0.83 DAGLA (0.37) KMT2ADAGLAPGRMAPTPOLB
SCHEMBL328544 0.82 DAGLA (0.35) KMT2ADAGLAPOLBCYP3A4CYP2C19
SCHEMBL6850664 0.79 DAGLA (0.43) DAGLAPGRPOLBALDH1A1
SCHEMBL6850484 0.79 DAGLA (0.36) KMT2ADAGLAPOLBCYP3A4CYP2C19
SCHEMBL6850244 0.78 EDNRA (0.39) DAGLACYP2C19HTT
SCHEMBL10066710 0.77 LSS (0.41) KMT2ADAGLAMEN1ALDH1A1
SCHEMBL6852280 0.77 BDKRB1 (0.40) KMT2ADAGLAMEN1TP53ALDH1A1

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-2428509-A1 Human adam-10 inhibitors Symphony Evolution, Inc. (US) 2012-03-14 EP disclosed