SCHEMBL8760852

SCHEMBL8760852

NC(CCCCCCOc1ccc2c(-c3ccc(Br)cc3)nccc2c1)C1CC1

nearest known ligand 0.55

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
LSS P48449 17/20 0.55
KDM4E B2RXH2 1/20 0.34
MEN1 O00255 1/20 0.34
MAPT P10636 1/20 0.34
KMT2A Q03164 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
SCHEMBL8478588 0.83 LSS (0.66) LSSKDM4EMEN1MAPTKMT2A
SCHEMBL8760654 0.81 LSS (0.56) LSS
SCHEMBL8760774 0.80 LSS (0.43) LSSKDM4E
SCHEMBL8762815 0.80 LSS (0.58) LSSKDM4E
SCHEMBL8478710 0.80 LSS (0.46) LSS
SCHEMBL8484710 0.78 LSS (0.55) LSSKDM4EMEN1MAPTKMT2A
SCHEMBL8760860 0.78 LSS (0.68) LSS
SCHEMBL8481533 0.77 LSS (0.64) LSSKDM4EMEN1MAPTKMT2A
SCHEMBL8481531 0.76 LSS (0.50) LSSMAPT
Fumaric Acid SCHEMBL8761342 0.74 LSS (0.42) LSS

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-0778271-A2 Aminoalkyl-substituted benzo-heterocyclic compounds F. HOFFMANN-LA ROCHE AG (CH) 1997-06-11 EP disclosed