SCHEMBL29244239

SCHEMBL29244239

CC1(C)C=Cc2cc(C(=O)NNc3ccc(C#N)cc3)ccc2O1

nearest known ligand 0.45

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
COXFA4 O00483 1/20 0.45
ABCC9 O60706 8/20 0.41
PTPN1 P18031 1/20 0.38
HIF1A Q16665 2/20 0.37
EPAS1 Q99814 1/20 0.37
ALDH1A1 P00352 2/20 0.37
CYP3A4 P08684 1/20 0.37
HPGD P15428 1/20 0.37
TDP1 Q9NUW8 1/20 0.37
MEN1 O00255 1/20 0.36
NPC1 O15118 1/20 0.36
RAB9A P51151 1/20 0.36
KMT2A Q03164 1/20 0.36
MAOA P21397 1/20 0.35
MAOB P27338 1/20 0.35
PTGS2 P35354 1/20 0.35
PKM P14618 1/20 0.34

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
SCHEMBL30874710 1.00 COXFA4 (0.45) COXFA4ABCC9PTPN1HIF1AEPAS1
SCHEMBL29244241 0.86 COXFA4 (0.48) COXFA4PTPN1HIF1AEPAS1ALDH1A1
SCHEMBL30874666 0.86 COXFA4 (0.48) COXFA4PTPN1HIF1AEPAS1ALDH1A1
SCHEMBL30874687 0.85 COXFA4 (0.47) COXFA4PTPN1HIF1AEPAS1ALDH1A1
SCHEMBL29244242 0.85 ALDH1A1 (0.49) COXFA4PTPN1HIF1AEPAS1ALDH1A1
SCHEMBL30874665 0.85 ALDH1A1 (0.49) COXFA4PTPN1HIF1AEPAS1ALDH1A1
SCHEMBL29244240 0.85 COXFA4 (0.47) COXFA4PTPN1HIF1AEPAS1ALDH1A1
SCHEMBL29244237 0.85 COXFA4 (0.49) COXFA4PTPN1HIF1AEPAS1ALDH1A1
SCHEMBL29244235 0.83 COXFA4 (0.53) COXFA4HIF1AEPAS1ALDH1A1HPGD
SCHEMBL30874650 0.83 COXFA4 (0.53) COXFA4HIF1AEPAS1ALDH1A1HPGD

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
CN-117946055-A Chromene aryl hydrazide derivative and preparation method and application thereof 贵州医科大学 2024-04-30 CN disclosed