SCHEMBL8765738

SCHEMBL8765738

NCCCCOc1ccccc1O

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 3/20 0.67
JAK2 O60674 1/20 0.67
LMNA P02545 1/20 0.67
MAPT P10636 1/20 0.67
KDM4E B2RXH2 1/20 0.52
HTR1B P28222 2/20 0.50
DRD2 P14416 1/20 0.49
DRD4 P21917 1/20 0.49
DRD3 P35462 1/20 0.49
SSTR2 P30874 1/20 0.48
SSTR4 P31391 1/20 0.48
TAAR1 Q96RJ0 1/20 0.45
APP P05067 1/20 0.44
TP53 P04637 2/20 0.43
CA1 P00915 1/20 0.43
CA2 P00918 1/20 0.43
TSHR P16473 1/20 0.43
ATM Q13315 1/20 0.42
MAPK1 P28482 1/20 0.42
RAB9A P51151 1/20 0.42

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
SCHEMBL2021873 0.94 GAA (0.69) GAAJAK2LMNAMAPTKDM4E
SCHEMBL9045649 0.89 GAA (0.82) GAAJAK2LMNAMAPTKDM4E
SCHEMBL277663 0.88 GAA (0.72) GAAJAK2LMNAMAPTKDM4E
SCHEMBL31567853 0.88 GAA (0.72) GAAJAK2LMNAMAPTKDM4E
SCHEMBL24011910 0.87 GAA (0.78) GAAJAK2LMNAMAPTDRD2
SCHEMBL9123832 0.87 GAA (0.78) GAAJAK2LMNAMAPTDRD2
Hydrochloric Acid SCHEMBL14999781 0.86 KDM4E (0.72) GAAJAK2LMNAMAPTKDM4E
SCHEMBL5621969 0.85 GAA (0.82) GAAJAK2LMNAMAPTKDM4E
SCHEMBL2637278 0.83 GAA (0.95) GAAJAK2LMNAMAPTKDM4E
SCHEMBL10583714 0.82 GAA (0.64) GAAJAK2LMNAMAPTKDM4E

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
EP-0778267-A1 SULFONAMIDE DERIVATIVES AND INSECTICIDE, MITICIDE AND NEMATICIDE CONTAINING THE SAME OTSUKA KAGAKU KABUSHIKI KAISHA (JP) 1997-06-11 EP disclosed