SCHEMBL11088535

SCHEMBL11088535

COC1(OC)CCCCCN1C

nearest known ligand 0.32

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
GRIN1 Q05586 1/20 0.32
GRIN2A Q12879 1/20 0.32
GRIN2B Q13224 1/20 0.32
SOS1 Q07889 1/20 0.30
SOS2 Q07890 1/20 0.30

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
SCHEMBL11866696 0.98 SOS1 (0.31) SOS1SOS2
SCHEMBL5915754 0.90
SCHEMBL5585792 0.81
SCHEMBL5585630 0.79
SCHEMBL9712178 0.76
SCHEMBL9712164 0.73
SCHEMBL28897962 0.73 GRIN1 (0.30) GRIN1GRIN2AGRIN2B
SCHEMBL5585611 0.71 GRIN1 (0.32) GRIN1GRIN2AGRIN2BSOS1SOS2
SCHEMBL19199755 0.69 SOS1 (0.50) SOS1SOS2
SCHEMBL14962058 0.69 SOS1 (0.50) SOS1SOS2

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-4463173-A ANTIBIOTIC, BACTERICIDE ICI PHARMA (FR) 1984-07-31 US disclosed