SCHEMBL8543773

SCHEMBL8543773

CCCOc1ccc(C(C=NOC(C)c2ccccc2C(=NOCC)C(=O)OC)=NOC)cc1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HIF1A Q16665 7/20 0.35
TAS1R3 Q7RTX0 1/20 0.34
TAS1R1 Q7RTX1 1/20 0.34
MAPT P10636 3/20 0.33
SMN1; SMN2 Q16637 3/20 0.33
RAB9A P51151 3/20 0.33
LMNA P02545 2/20 0.33
MITF O75030 1/20 0.33
NLRP1 Q9C000 1/20 0.33
PLK1 P53350 1/20 0.33
MEN1 O00255 2/20 0.33
KMT2A Q03164 2/20 0.33
FAAH O00519 1/20 0.33
NPC1 O15118 1/20 0.33
NFKB1 P19838 1/20 0.33
NFKB2 Q00653 1/20 0.33
RELA Q04206 1/20 0.33
MAPK1 P28482 1/20 0.33
POLB P06746 2/20 0.32
ALDH1A1 P00352 1/20 0.32

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
SCHEMBL7500395 0.95 HIF1A (0.39) HIF1ATAS1R3TAS1R1MAPTSMN1; SMN2
SCHEMBL8538331 0.90 HIF1A (0.37) HIF1AMAPTLMNAL3MBTL1
SCHEMBL7505113 0.86 PLK1 (0.39) TAS1R3TAS1R1MAPTSMN1; SMN2RAB9A
SCHEMBL7494764 0.85 HIF1A (0.40) HIF1AMAPTFAAH
SCHEMBL7501618 0.83 HIF1A (0.40) HIF1ALMNAFAAH
SCHEMBL7495599 0.83 ALDH1A1 (0.38) MAPTRAB9ALMNAPLK1MEN1
SCHEMBL7130516 0.82 HIF1A (0.42) HIF1AMAPTSMN1; SMN2RAB9ALMNA
SCHEMBL7742093 0.80 HIF1A (0.42) HIF1AMAPTLMNAALDH1A1L3MBTL1
SCHEMBL7502694 0.79 HIF1A (0.42) HIF1ALMNA
SCHEMBL7494944 0.78 HIF1A (0.34) HIF1AMAPTLMNAMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0865424-A1 PESTICIDES Novartis AG (CH) 1998-09-23 EP disclosed
WO-1997020809-A1 PESTICIDES NOVARTIS AG (CH) 1997-06-12 WO disclosed