SCHEMBL8423536

SCHEMBL8423536

OC1(c2ccc3c(c2)OCO3)CCC(Cc2cc(F)ccc2F)(N2CCNCC2)CC1

nearest known ligand 0.55

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.47
SIGMAR1 Q99720 1/20 0.42
HTR1D P28221 1/20 0.38
GAA P10253 1/20 0.38
MAPK1 P28482 1/20 0.38
HTT P42858 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38

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
SCHEMBL8421954 0.88 LMNA (0.48) LMNASIGMAR1HTR1D
SCHEMBL8422351 0.88 DRD2 (0.39)
SCHEMBL8423963 0.86 LMNA (0.46) LMNASIGMAR1HTR1DGAAMAPK1
SCHEMBL8425744 0.82 GAA (0.44) LMNASIGMAR1HTR1DGAAMAPK1
SCHEMBL8422132 0.81 HTR1D (0.43) LMNASIGMAR1HTR1DGAAMAPK1
SCHEMBL8422448 0.81 HTR1D (0.43) LMNASIGMAR1HTR1DGAAMAPK1
SCHEMBL8422259 0.81 HTR1D (0.43) LMNASIGMAR1HTR1DGAAMAPK1
SCHEMBL8425741 0.81 NPSR1 (0.52) LMNASIGMAR1HTR1DGAAMAPK1
SCHEMBL8423722 0.79 HTR1D (0.41) LMNASIGMAR1HTR1DGAAMAPK1
SCHEMBL8425616 0.78 HTR1D (0.45) LMNASIGMAR1HTR1DGAAMAPK1

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
US-5919802-A Methods of preventing and/or treating temporal lobe epilepsy PRINCETON UNIVERSITY (US) 1999-07-06 US disclosed