SCHEMBL9694473

SCHEMBL9694473

COc1cc(OC)nc(Oc2ccccc2C=NNc2ccccc2)n1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 5/20 0.50
MAPT P10636 3/20 0.44
KDM4E B2RXH2 1/20 0.44
APAF1 O14727 1/20 0.44
NSD2 O96028 1/20 0.44
MAPK1 P28482 1/20 0.44
SAE1 Q9UBE0 1/20 0.44
UBA2 Q9UBT2 1/20 0.44
MEN1 O00255 3/20 0.44
KMT2A Q03164 3/20 0.44
RAB9A P51151 3/20 0.44
SMN1; SMN2 Q16637 3/20 0.44
NPC1 O15118 2/20 0.44
TP53 P04637 1/20 0.44
ALDH1A1 P00352 4/20 0.43
HPGD P15428 1/20 0.43
GFER P55789 1/20 0.43
PKM P14618 2/20 0.43
MITF O75030 1/20 0.43
PAX8 Q06710 1/20 0.43

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
SCHEMBL9694470 1.00 GAA (0.50) GAAMAPTKDM4EAPAF1NSD2
SCHEMBL9732218 0.89 GAA (0.45) GAAMAPTKDM4EAPAF1NSD2
SCHEMBL9422717 0.86 GAA (0.49) GAAMAPTKDM4EAPAF1NSD2
SCHEMBL9422716 0.86 GAA (0.49) GAAMAPTKDM4EAPAF1NSD2
SCHEMBL9735339 0.86 MAPT (0.50) GAAMAPTKDM4EAPAF1NSD2
SCHEMBL9732486 0.86 SLC2A1 (0.50) GAAMAPTKDM4EAPAF1NSD2
SCHEMBL9732722 0.83 CTSA (0.41) GAAMAPTKDM4EMAPK1MEN1
SCHEMBL9382970 0.83 CTSA (0.41) GAAMAPTKDM4EMAPK1MEN1
SCHEMBL9732677 0.83 KMT2A (0.51) GAAMAPTKDM4EMAPK1MEN1
SCHEMBL9733071 0.82 ALDH1A1 (0.49) GAAKDM4ESMN1; SMN2ALDH1A1LMNA

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-1992013846-A1 PYRIMIDINYL- AND TRIAZINYLSALICYL- AND -PICOLINYLALDEHYDE DERIVATIVES CIBA-GEIGY AG (CH) 1992-08-20 WO claimed
US-5167693-A Pre- and postemergence BAYER AKTIENGESELLSCHAFT (DE) 1992-12-01 US disclosed
WO-1992013846-A1 PYRIMIDINYL- AND TRIAZINYLSALICYL- AND -PICOLINYLALDEHYDE DERIVATIVES CIBA-GEIGY AG (CH) 1992-08-20 WO disclosed
EP-0459243-A2 Substituted Azines BAYER AG (DE) 1991-12-04 EP disclosed