SCHEMBL18834993

SCHEMBL18834993

COC1CCN(Cc2ccccc2)C(C)C1

nearest known ligand 0.50

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.50
HRH2 P25021 1/20 0.47
ACHE P22303 1/20 0.45
GBA1 P04062 1/20 0.44
SCN1A P35498 2/20 0.43
SCN8A Q9UQD0 2/20 0.43
SIGMAR1 Q99720 3/20 0.43
HTR1A P08908 2/20 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
SCHEMBL14660573 0.85 HRH3 (0.51) ACHEGBA1SIGMAR1HTR1A
SCHEMBL19290959 0.84 MAPT (0.60) MAPTHRH2SIGMAR1
SCHEMBL27616211 0.84 MAPT (0.60) MAPTHRH2SIGMAR1
SCHEMBL12424244 0.82 ACHE (0.61) MAPTHRH2ACHEGBA1SIGMAR1
SCHEMBL20588229 0.80 ACHE (0.56) MAPTHRH2ACHEGBA1SIGMAR1
SCHEMBL6853255 0.80 ACHE (0.56) MAPTHRH2ACHEGBA1SIGMAR1
SCHEMBL18834714 0.78 MAPT (0.60) MAPTHRH2ACHEGBA1SIGMAR1
SCHEMBL2294097 0.78 MAPT (0.53) MAPTHRH2ACHEGBA1SIGMAR1
SCHEMBL31380063 0.76 MAPT (0.53) MAPT
SCHEMBL31380064 0.76 MAPT (0.53) MAPT

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-2734521-B1 TETRAHYDROPYRIDO-PYRIDINE AND TETRAHYDROPYRIDO-PYRIMIDINE COMPOUNDS AND USE THEREOF AS C5A RECEPTOR MODULATORS NOVARTIS AG (CH) 2017-05-10 EP disclosed