SCHEMBL7286387

SCHEMBL7286387

Cc1ccc(CC2(O)CCN(C/C=C/c3ccc(O)cc3)CC2)cc1

nearest known ligand 0.59

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
GRIN2B Q13224 9/20 0.59
GRIN2D O15399 7/20 0.59
GRIN3B O60391 7/20 0.59
GRIN1 Q05586 7/20 0.59
GRIN2A Q12879 7/20 0.59
GRIN2C Q14957 7/20 0.59
GRIN3A Q8TCU5 7/20 0.59
ADRA1A P35348 6/20 0.59
ADRA1D P25100 4/20 0.59
ADRA1B P35368 4/20 0.59
MAPT P10636 1/20 0.58
LTA4H P09960 1/20 0.42
ALDH1A1 P00352 1/20 0.41
MEN1 O00255 1/20 0.40
MAPK1 P28482 1/20 0.40
KMT2A Q03164 1/20 0.40

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
SCHEMBL7286395 1.00 GRIN2B (0.59) GRIN2BGRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL7286810 0.79 MAPT (0.55) GRIN2BGRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL21651971 0.74 GRIN2B (0.59) GRIN2BGRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL7295407 0.74 GRIN2B (1.00) GRIN2BGRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL27439499 0.74 GRIN2B (0.60) GRIN2BGRIN2DGRIN3BGRIN1GRIN2A
Hydrochloric Acid SCHEMBL7288840 0.73 GRIN2B (0.98) GRIN2BGRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL499394 0.73 GRIN2D (1.00) GRIN2BGRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL7288999 0.72 GRIN2B (0.58) GRIN2BGRIN2DGRIN3BGRIN1GRIN2A
Hydrochloric Acid SCHEMBL1994218 0.72 GRIN2D (0.98) GRIN2BGRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL15759176 0.72 LTA4H (0.63) ADRA1AADRA1DLTA4HALDH1A1MAPK1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0824098-B1 4-hydroxy-piperidine derivatives HOFFMANN LA ROCHE (CH) 2001-10-31 EP disclosed
EP-0824098-A1 4-hydroxy-piperidine derivatives F. HOFFMANN-LA ROCHE AG (CH) 1998-02-18 EP disclosed