SCHEMBL8487885

SCHEMBL8487885

CCCN1CCC(O)(Cc2ccccc2)C(Oc2ccc(O)cc2)C1O

nearest known ligand 0.38

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.36
GRIN2D O15399 2/20 0.35
GRIN3B O60391 2/20 0.35
GRIN1 Q05586 2/20 0.35
GRIN2A Q12879 2/20 0.35
GRIN2B Q13224 2/20 0.35
GRIN2C Q14957 2/20 0.35
GRIN3A Q8TCU5 2/20 0.35
MAPT P10636 1/20 0.35
OPRD1 P41143 3/20 0.35
ADRA1D P25100 1/20 0.34
ADRA1A P35348 1/20 0.34
ADRA1B P35368 1/20 0.34
OPRM1 P35372 2/20 0.34
OPRK1 P41145 2/20 0.34
SIGMAR1 Q99720 2/20 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
Hydrochloric Acid SCHEMBL8482027 0.99 OPRD1 (0.36) LMNAGRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL8482334 0.92 NPC1 (0.40) LMNA
SCHEMBL8487751 0.91 LMNA (0.35) LMNAMAPTOPRD1OPRM1OPRK1
Hydrochloric Acid SCHEMBL8484743 0.90 LMNA (0.34) LMNAMAPTOPRD1OPRM1OPRK1
Hydrochloric Acid SCHEMBL8485944 0.90 GRIN2B (0.45) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL8481608 0.87 GRIN2D (0.40) LMNAGRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL8482609 0.86 NPC1 (0.39) GRIN1GRIN2B
Hydrochloric Acid SCHEMBL8483147 0.77 GRIN2B (0.40) LMNAGRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL8485218 0.73 GRIN2B (0.42) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
Hydrochloric Acid SCHEMBL8485872 0.72 GRIN2B (0.42) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B

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-5889026-A 4-hydroxy-piperodine derivatives HOFFMANN-LA ROCHE INC. (US) 1999-03-30 US disclosed