SCHEMBL8872091

SCHEMBL8872091

Fc1ccc(CC2CCNCC2)cc1.O=C(CCN1CCC(Cc2ccc(F)cc2)CC1)c1ccc2[nH]c(=O)[nH]c2c1

nearest known ligand 0.67

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
GRIN2B Q13224 5/20 0.67
GRIN1 Q05586 4/20 0.67
GRIN2D O15399 3/20 0.67
GRIN3B O60391 3/20 0.67
GRIN2A Q12879 3/20 0.67
GRIN2C Q14957 3/20 0.67
GRIN3A Q8TCU5 3/20 0.67

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
SCHEMBL8542333 0.95 GRIN2B (0.73) GRIN2BGRIN1GRIN2DGRIN3BGRIN2A
SCHEMBL8547576 0.85 GRIN2B (0.67) GRIN2BGRIN1GRIN2DGRIN3BGRIN2A
SCHEMBL7529124 0.82 GRIN2B (0.70) GRIN2BGRIN1GRIN2DGRIN3BGRIN2A
SCHEMBL8541660 0.82 GRIN2B (0.59) GRIN2BGRIN1GRIN2DGRIN3BGRIN2A
SCHEMBL1908150 0.80 GRIN2B (1.00) GRIN2BGRIN1GRIN2DGRIN3BGRIN2A
SCHEMBL8540772 0.80 GRIN2B (0.58) GRIN2BGRIN1GRIN2DGRIN3BGRIN2A
SCHEMBL4675336 0.77 GRIN1 (0.66) GRIN2BGRIN1GRIN2DGRIN3BGRIN2A
SCHEMBL8548110 0.76 GRIN2B (0.64) GRIN2BGRIN1GRIN2DGRIN3BGRIN2A
SCHEMBL8544509 0.76 GRIN2B (0.67) GRIN2BGRIN1GRIN2DGRIN3BGRIN2A
SCHEMBL9053418 0.75 CCR3 (0.65) GRIN2B

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-5698553-A Benzylpiperidine derivatives MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 1997-12-16 US disclosed