SCHEMBL8096545

SCHEMBL8096545

CO/N=C(\C(N)=O)c1ccccc1CO/N=C(\C)[C@@H]1C[C@H]1c1ccc(OC)cc1

nearest known ligand 0.50

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.50
L3MBTL1 Q9Y468 3/20 0.50
HPGD P15428 1/20 0.48
RAB9A P51151 4/20 0.42
NPC1 O15118 2/20 0.40
SMN1; SMN2 Q16637 2/20 0.40
NPSR1 Q6W5P4 1/20 0.40
HIF1A Q16665 5/20 0.38
SLC9A1 P19634 1/20 0.36
GPR88 Q9GZN0 1/20 0.36
MAOA P21397 1/20 0.36
TDP1 Q9NUW8 2/20 0.35
MAPK1 P28482 1/20 0.35
NAAA Q02083 1/20 0.35
ALDH1A1 P00352 1/20 0.35
LMNA P02545 1/20 0.35

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
SCHEMBL6224854 1.00 MAPT (0.50) MAPTL3MBTL1HPGDRAB9ANPC1
SCHEMBL6224850 1.00 MAPT (0.50) MAPTL3MBTL1HPGDRAB9ANPC1
SCHEMBL6227065 0.92 MAPK1 (0.42) MAPTL3MBTL1HPGDSMN1; SMN2HIF1A
SCHEMBL6227062 0.92 MAPK1 (0.42) MAPTL3MBTL1HPGDSMN1; SMN2HIF1A
SCHEMBL6227068 0.92 MAPK1 (0.42) MAPTL3MBTL1HPGDSMN1; SMN2HIF1A
SCHEMBL6250831 0.91 HPGD (0.47) MAPTL3MBTL1HPGDRAB9ANPC1
SCHEMBL6250834 0.91 HPGD (0.47) MAPTL3MBTL1HPGDRAB9ANPC1
SCHEMBL6230235 0.91 HIF1A (0.48) MAPTL3MBTL1HPGDRAB9ANPC1
SCHEMBL6253928 0.91 HIF1A (0.48) MAPTL3MBTL1HPGDRAB9ANPC1
SCHEMBL6229612 0.91 HIF1A (0.48) MAPTL3MBTL1HPGDRAB9ANPC1

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
US-6063956-A APPLYING FUNGICIDE OR INSECTICIDE TO THE LOCUS WHERE CONTROL IS DESIRED ROHM AND HAAS COMPANY (US) 2000-05-16 US disclosed