SCHEMBL28290953

SCHEMBL28290953

O=COCCC1=NOC(COCc2ccccc2)C1

nearest known ligand 0.41

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.41
TAAR1 Q96RJ0 1/20 0.39
ITGB3 P05106 8/20 0.37
ITGAV P06756 7/20 0.37
ITGA2B P08514 7/20 0.37
HRH4 Q9H3N8 4/20 0.36
HRH3 Q9Y5N1 4/20 0.36
PTPN1 P18031 1/20 0.35
CDC25B P30305 1/20 0.35
DRD1 P21728 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
SCHEMBL28292346 0.91 ITGB3 (0.34) LMNAITGB3ITGAVITGA2B
SCHEMBL28290929 0.89 ITGB3 (0.38) LMNATAAR1ITGB3ITGAVITGA2B
SCHEMBL28290913 0.87 ITGB3 (0.38) LMNAITGB3ITGAVITGA2BHRH4
SCHEMBL28290944 0.86 ITGB3 (0.37) LMNAITGB3ITGAVITGA2BHRH4
SCHEMBL28292335 0.85 ITGB3 (0.37) LMNAITGB3ITGAVITGA2BHRH4
SCHEMBL28290928 0.85
SCHEMBL28290921 0.84 PPARG (0.40) TAAR1ITGB3ITGAVITGA2B
SCHEMBL28292352 0.83 TDP1 (0.43) LMNAITGB3ITGA2BHRH3DRD1
SCHEMBL28145266 0.78 LMNA (0.45) LMNATAAR1HRH4HRH3PTPN1
SCHEMBL28292350 0.77 TAAR1 (0.39) TAAR1ITGB3ITGA2B

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-106572659-B Harmful arthropod agent for preventing and eliminating containing amide compound 住友化学株式会社 2019-05-10 CN disclosed