SCHEMBL20256286

SCHEMBL20256286

COc1ccc(CN(Sc2cc(Cl)c(NCc3cccc(F)c3)cc2F)c2nccs2)c(OC)c1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.37
LMNA P02545 4/20 0.37
TP53 P04637 2/20 0.37
CLK4 Q9HAZ1 5/20 0.35
MEN1 O00255 3/20 0.35
KMT2A Q03164 3/20 0.35
PTPN7 P35236 1/20 0.35
DUSP3 P51452 1/20 0.35
CYP1A2 P05177 4/20 0.34
CYP3A4 P08684 4/20 0.34
CYP2D6 P10635 4/20 0.34
TSHR P16473 4/20 0.34
CYP2C19 P33261 4/20 0.34
ALDH1A1 P00352 2/20 0.34
GLA P06280 1/20 0.34
EGFR P00533 2/20 0.33
CHEK1 O14757 1/20 0.33
P2RX7 Q99572 1/20 0.33
AURKA O14965 1/20 0.33
RPS6KB1 P23443 1/20 0.33

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
SCHEMBL20256471 0.94 ALDH1A1 (0.37) MAPTLMNACLK4MEN1KMT2A
SCHEMBL20256130 0.93 CYP1A2 (0.37) LMNACLK4MEN1KMT2ACYP1A2
SCHEMBL20256548 0.93 MEN1 (0.34) MAPTLMNACLK4MEN1KMT2A
SCHEMBL20256212 0.92 MITF (0.40) MAPTLMNACLK4MEN1KMT2A
SCHEMBL20256159 0.91 KMT2A (0.39) LMNACLK4MEN1KMT2ACYP1A2
SCHEMBL20256524 0.90 KDM4E (0.36) MAPTLMNACLK4MEN1KMT2A
SCHEMBL20256424 0.90 SCN1A (0.36) MAPTLMNACLK4MEN1KMT2A
SCHEMBL20256174 0.87 CYP1A2 (0.37) MAPTLMNACLK4MEN1KMT2A
SCHEMBL20256699 0.87 KDM4E (0.38) MAPTLMNACLK4MEN1KMT2A
SCHEMBL20256162 0.87 SCN1A (0.41) MAPTLMNACLK4MEN1KMT2A

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
WO-2018106284-A1 BENZENESULFONAMIDE COMPOUNDS AND THEIR USE AS THERAPEUTIC AGENTS XENON PHARMACEUTICALS INC. (CA) 2018-06-14 WO disclosed