SCHEMBL28067366

SCHEMBL28067366

Cn1ccc(-c2cc(F)cc(F)c2)n1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SCN4A P35499 1/20 0.56
KMT2A Q03164 1/20 0.55
KEAP1 Q14145 1/20 0.52
CYP19A1 P11511 1/20 0.46
PIK3CD O00329 1/20 0.41
PIP5K1C O60331 1/20 0.41
PIK3CA P42336 1/20 0.41
PIK3CB P42338 1/20 0.41
PI4KA P42356 1/20 0.41
PIK3CG P48736 1/20 0.41
PI4KB Q9UBF8 1/20 0.41
MKNK1 Q9BUB5 1/20 0.40
MKNK2 Q9HBH9 1/20 0.40
NOTUM Q6P988 1/20 0.38
TGFBR1 P36897 2/20 0.38
DRD2 P14416 1/20 0.38
JMJD6 Q6NYC1 4/20 0.38
KCNH2 Q12809 1/20 0.35
CASP6 P55212 1/20 0.35
MAPT P10636 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
SCHEMBL24378466 0.82 KMT2A (0.60) SCN4AKMT2AKEAP1CYP19A1PIK3CD
SCHEMBL25646042 0.81 MKNK1 (0.52) SCN4AKMT2AKEAP1CYP19A1PIK3CD
SCHEMBL989300 0.81 SCN4A (0.79) SCN4AKMT2AKEAP1CYP19A1PIK3CD
SCHEMBL30767766 0.78 KMT2A (0.42) SCN4AKMT2AKEAP1CYP19A1MKNK1
SCHEMBL30767764 0.78 KMT2A (0.42) SCN4AKMT2AKEAP1CYP19A1MKNK1
SCHEMBL14277965 0.76 KEAP1 (0.53) SCN4AKMT2AKEAP1CYP19A1PIK3CD
SCHEMBL15885604 0.75 KMT2A (0.55) SCN4AKMT2AKEAP1CYP19A1PIK3CD
SCHEMBL21875456 0.74 KMT2A (0.46) SCN4AKMT2AKEAP1CYP19A1PIK3CD
SCHEMBL21875482 0.74 KMT2A (0.46) SCN4AKMT2AKEAP1CYP19A1PIK3CD
SCHEMBL20456872 0.74 KMT2A (0.46) SCN4AKMT2AKEAP1CYP19A1PIK3CD

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-103153999-B Compounds as cannabinoid receptor-1 inhibitors AMOREPACIFIC CORP. (KR) 2016-06-01 CN disclosed