SCHEMBL26665153

SCHEMBL26665153

CCCCCC(=Cc1ccc(Cl)cc1)C(=O)c1ccccc1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CES2 O00748 5/20 0.57
CES1 P23141 5/20 0.57
LMNA P02545 2/20 0.47
TDP1 Q9NUW8 1/20 0.46
MAOB P27338 1/20 0.46
PTGS2 P35354 1/20 0.42
ALDH1A1 P00352 3/20 0.42
NPSR1 Q6W5P4 2/20 0.42
MEN1 O00255 1/20 0.42
NPC1 O15118 1/20 0.42
CYP1A2 P05177 1/20 0.42
CYP3A4 P08684 1/20 0.42
MAPT P10636 1/20 0.42
CYP2C9 P11712 1/20 0.42
CYP2C19 P33261 1/20 0.42
HTT P42858 1/20 0.42
RAB9A P51151 1/20 0.42
KMT2A Q03164 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
GLA P06280 1/20 0.41

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
SCHEMBL10497754 0.89 CES2 (0.67) CES2CES1LMNATDP1MAPT
SCHEMBL28653274 0.87 ALDH1A1 (0.50) CES2CES1LMNAPTGS2ALDH1A1
SCHEMBL28623785 0.86 CES2 (0.57) CES2CES1LMNATDP1PTGS2
SCHEMBL5685283 0.86 KCNH2 (0.43) CES2CES1LMNAMAOBPTGS2
SCHEMBL2989494 0.86 CES2 (0.65) CES2CES1LMNATDP1PTGS2
SCHEMBL28660036 0.83 CES2 (0.54) CES2CES1LMNATDP1MAOB
SCHEMBL26665155 0.82 CES2 (0.55) CES2CES1LMNATDP1MEN1
SCHEMBL24495719 0.82 CES2 (0.43) CES2CES1LMNAMAOBPTGS2
SCHEMBL13484610 0.82 CES2 (0.44) CES2CES1LMNAMAOBPTGS2
SCHEMBL20415256 0.81 EGFR (0.49) CES2CES1LMNAMAOBPTGS2

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023206835-A1 CROSS-LINKED NORBORNENE COPOLYMER/CARBON BLACK THREE-DIMENSIONAL NETWORK IMMOBILIZED BIMETALLIC COPPER/GOLD NANO-CATALYST, AND PREPARATION METHOD THEREFOR AND USE THEREOF 湖北工程学院 2023-11-02 WO claimed
WO-2023206835-A1 CROSS-LINKED NORBORNENE COPOLYMER/CARBON BLACK THREE-DIMENSIONAL NETWORK IMMOBILIZED BIMETALLIC COPPER/GOLD NANO-CATALYST, AND PREPARATION METHOD THEREFOR AND USE THEREOF 湖北工程学院 2023-11-02 WO disclosed