SCHEMBL21653193

SCHEMBL21653193

CCn1cc(NC(=O)c2ccc(Cl)c(F)c2)ccc1=O

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KCNQ3 O43525 4/20 0.53
▸ KCNQ2 O43526 4/20 0.53
▸ KCNE1 P15382 3/20 0.53
▸ KCNQ1 P51787 3/20 0.53
▸ KCNQ5 Q9NR82 1/20 0.52
▸ CHRM1 P11229 1/20 0.52
▸ MAOB P27338 5/20 0.50
▸ MAPT P10636 5/20 0.49
▸ RAB9A P51151 3/20 0.45
▸ NPC1 O15118 2/20 0.45
▸ KDM4E B2RXH2 1/20 0.45
▸ MEN1 O00255 1/20 0.45
▸ PKM P14618 1/20 0.45
▸ KMT2A Q03164 1/20 0.45
▸ LMNA P02545 1/20 0.44
▸ TP53 P04637 1/20 0.44
▸ CYP1A2 P05177 1/20 0.43
▸ CYP3A4 P08684 1/20 0.43
▸ CYP2D6 P10635 1/20 0.43
▸ CYP2C9 P11712 1/20 0.43

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
SCHEMBL21653184 0.91 KCNQ3 (0.53) KCNQ3KCNQ2KCNE1KCNQ1CHRM1
SCHEMBL21653176 0.89 MEN1 (0.58) KCNQ3KCNQ2KCNE1KCNQ1MAOB
SCHEMBL21653182 0.82 KMT2A (0.52) KCNQ3KCNQ2KCNE1KCNQ1MAPT
SCHEMBL21653177 0.81 MAPT (0.46) CHRM1MAPTRAB9ANPC1KDM4E
SCHEMBL21653190 0.81 ALDH1A1 (0.54) KCNQ3KCNQ2KCNE1KCNQ1KCNQ5
SCHEMBL21653246 0.78 MAPT (0.43) CHRM1MAOBMAPTRAB9ANPC1
SCHEMBL21652915 0.77 CREBBP (0.55) MAPTRAB9ANPC1KDM4EMEN1
SCHEMBL21652920 0.77 MAPT (0.42) MAOBMAPTRAB9ANPC1MEN1
SCHEMBL21653187 0.76 ALDH1A1 (0.50) CHRM1MAPTRAB9ANPC1KDM4E
SCHEMBL21652987 0.76 RAB9A (0.64) MAPTRAB9ANPC1KDM4EMEN1

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
WO-2020023657-A1 PYRIDIN-2-ONE COMPOUNDS USEFUL AS SMARCA2 ANTAGONISTS Epizyme, Inc. (US) 2020-01-30 — — WO disclosed
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