SCHEMBL6667586

SCHEMBL6667586

CCCCCCCCCCCCOc1cc(O)c(N=Nc2ccc(N=Nc3ccccc3)cc2)c2ccccc12

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KCNH2 Q12809 3/20 0.48
ALPL P05186 1/20 0.44
ALPG P10696 1/20 0.44
THRB P10828 2/20 0.42
CHUK O15111 1/20 0.41
DAPK3 O43293 1/20 0.41
JAK2 O60674 1/20 0.41
ROCK2 O75116 1/20 0.41
PRKCG P05129 1/20 0.41
CDK1 P06493 1/20 0.41
PIM1 P11309 1/20 0.41
RPS6KB1 P23443 1/20 0.41
CDK2 P24941 1/20 0.41
AKT1 P31749 1/20 0.41
AKT2 P31751 1/20 0.41
MAPKAPK2 P49137 1/20 0.41
BLK P51451 1/20 0.41
RPS6KA3 P51812 1/20 0.41
JAK3 P52333 1/20 0.41
LIMK1 P53667 1/20 0.41

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
SCHEMBL6667583 1.00 KCNH2 (0.48) KCNH2ALPLALPGTHRBCHUK
SCHEMBL11745835 0.82 SMPD1 (0.51) KCNH2CHUKDAPK3JAK2ROCK2
SCHEMBL11745839 0.82 SMPD1 (0.51) KCNH2CHUKDAPK3JAK2ROCK2
SCHEMBL4129980 0.80 MEN1 (0.48) KCNH2THRBCHUKDAPK3JAK2
SCHEMBL6670318 0.80 KCNH2 (0.43) KCNH2ALPLALPGCNR2
SCHEMBL6670320 0.80 KCNH2 (0.43) KCNH2ALPLALPGCNR2
SCHEMBL6663874 0.79 CNR1 (0.40) ALPLALPGTHRBCNR1CNR2
SCHEMBL6663876 0.79 CNR1 (0.40) ALPLALPGTHRBCNR1CNR2
SCHEMBL26172963 0.78 KCNH2 (0.53) KCNH2ALPLALPGTHRBCHUK
SCHEMBL8428510 0.77 MPL (0.54) ALPLALPGTHRBMEN1KMT2A

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-1452338-A1 Patterned dichroic security features Eidgenössische Technische Hochschule (ETH) (CH) 2004-09-01 EP disclosed