SCHEMBL8524457

SCHEMBL8524457

COc1nn(C)c(=O)n1-c1ccccc1Oc1nc(I)ns1

nearest known ligand 0.34

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.34
MEN1 O00255 2/20 0.32
KMT2A Q03164 2/20 0.32
TSHR P16473 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
BRD4 O60885 1/20 0.32
APLNR P35414 4/20 0.31
MAPT P10636 2/20 0.31
TP53 P04637 1/20 0.31
LMNA P02545 1/20 0.31
KDM4E B2RXH2 2/20 0.31
ALDH1A1 P00352 2/20 0.31
HPGD P15428 2/20 0.31
RAB9A P51151 1/20 0.31
PDE4A P27815 1/20 0.31
PDE11A Q9HCR9 1/20 0.31
PDE10A Q9Y233 1/20 0.31
HTT P42858 1/20 0.30
BRD9 Q9H8M2 1/20 0.30

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
SCHEMBL8590947 0.83 DHPS (0.37) SMN1; SMN2MAPTTP53LMNABRD9
SCHEMBL8811476 0.81 MAPT (0.38) SMN1; SMN2MEN1KMT2AL3MBTL1MAPT
SCHEMBL8810747 0.80 MEN1 (0.32) SMN1; SMN2MEN1KMT2ALMNA
SCHEMBL8595988 0.79 EIF4E (0.35) SMN1; SMN2MEN1KMT2AMAPTLMNA
SCHEMBL8816645 0.78 LMNA (0.32) SMN1; SMN2BRD4LMNAKDM4EALDH1A1
SCHEMBL8595340 0.78 RORB (0.34) SMN1; SMN2MEN1KMT2ALMNAKDM4E
SCHEMBL8524019 0.76 TSHR (0.35) SMN1; SMN2TSHRAPLNRLMNAKDM4E
SCHEMBL8550685 0.76 PSEN1 (0.36) MAPTPDE10A
SCHEMBL8815698 0.75 LMNA (0.32) SMN1; SMN2MAPTTP53LMNA
SCHEMBL8484212 0.74 SMN1; SMN2 (0.47) SMN1; SMN2MEN1KMT2ATSHRBRD4

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-1999018102-A1 FUNGICIDAL AND ARTHROPODICIDAL CYCLIC AMIDES E.I. DU PONT DE NEMOURS AND COMPANY (US) 1999-04-15 WO disclosed