SCHEMBL28115945

SCHEMBL28115945

C=CC(=O)N1CC=Cc2ccccc21

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.39
TSHR P16473 1/20 0.39
MAPK1 P28482 1/20 0.39
SCN4A P35499 1/20 0.39
SCN5A Q14524 1/20 0.39
SCN9A Q15858 1/20 0.39
GSK3B P49841 5/20 0.38
P2RX4 Q99571 9/20 0.37
P2RX1 P51575 4/20 0.37
P2RX3 P56373 4/20 0.37
P2RX7 Q99572 2/20 0.35
ACHE P22303 2/20 0.34
TET3 O43151 1/20 0.34
KMT2A Q03164 1/20 0.34
FBXL19 Q6PCT2 1/20 0.34
CXXC5 Q7LFL8 1/20 0.34
TET1 Q8NFU7 1/20 0.34
KDM2B Q8NHM5 1/20 0.34
CXXC4 Q9H2H0 1/20 0.34
KDM2A Q9Y2K7 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
SCHEMBL28144791 0.81 P2RX4 (0.37) LMNATSHRMAPK1SCN4ASCN5A
SCHEMBL28860673 0.81 MTNR1A (0.37) P2RX4SMN1; SMN2
SCHEMBL29376182 0.80 P2RX4 (0.44) LMNATSHRMAPK1SCN4ASCN5A
SCHEMBL3375661 0.80 P2RX4 (0.44) LMNATSHRMAPK1SCN4ASCN5A
SCHEMBL1286806 0.78 LMNA (0.55) LMNATSHRMAPK1SCN4ASCN5A
SCHEMBL1477941 0.78 NOTUM (0.46) LMNATSHRMAPK1SCN4ASCN5A
SCHEMBL3241414 0.77 P2RX4 (0.42) LMNATSHRMAPK1SCN4ASCN5A
Hydrochloric Acid SCHEMBL28145471 0.77 LMNA (0.53) LMNATSHRMAPK1SCN4ASCN5A
SCHEMBL9420574 0.76 LMNA (0.45) LMNATSHRMAPK1SCN4ASCN5A
SCHEMBL28459434 0.76

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
CN-106256841-A Contact lens material, method for producing the same and contact lens produced by the method 明基材料股份有限公司 2016-12-28 CN claimed
CN-106256841-A Contact lens material, method for producing the same and contact lens produced by the method 明基材料股份有限公司 2016-12-28 CN disclosed