SCHEMBL8342162

SCHEMBL8342162

CNC(=O)/C(=N\OC)c1ccccc1COc1ncc(C)cc1Br

nearest known ligand 0.47

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
HIF1A Q16665 8/20 0.46
GABRA5 P31644 2/20 0.37
PDCD1 Q15116 1/20 0.34
CD274 Q9NZQ7 1/20 0.34
ULK1 O75385 1/20 0.33
PRKAA2 P54646 1/20 0.33
PRKAA1 Q13131 1/20 0.33
ULK2 Q8IYT8 1/20 0.33
ALDH1A1 P00352 1/20 0.33
SGMS2 Q8NHU3 2/20 0.32
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
OPRL1 P41146 1/20 0.31

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
SCHEMBL8342165 1.00 HIF1A (0.46) HIF1AGABRA5PDCD1CD274ULK1
SCHEMBL8341966 0.86 HIF1A (0.46) HIF1ASGMS2MEN1KMT2AOPRL1
SCHEMBL8341964 0.86 HIF1A (0.46) HIF1ASGMS2MEN1KMT2AOPRL1
SCHEMBL8339227 0.85 HIF1A (0.43) HIF1AALDH1A1SGMS2
SCHEMBL8339226 0.85 HIF1A (0.43) HIF1AALDH1A1SGMS2
SCHEMBL829036 0.81 HIF1A (0.49) HIF1ASGMS2
SCHEMBL829037 0.81 HIF1A (0.49) HIF1ASGMS2
SCHEMBL7685375 0.80 HIF1A (0.52) HIF1AULK1OPRL1
SCHEMBL7685378 0.80 HIF1A (0.52) HIF1AULK1OPRL1
SCHEMBL8399045 0.80 HIF1A (0.57) HIF1AALDH1A1MEN1KMT2A

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-5968875-A FUNGICIDES FOR PLANTS DOW AGROSCIENCES LLC (US) 1999-10-19 US disclosed