SCHEMBL8417111

SCHEMBL8417111

CC1CCC(NC2C[CH]C(C)(C)C2)C1

nearest known ligand 0.33

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
RB1 P06400 5/20 0.33
TSHR P16473 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33

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
SCHEMBL8417104 0.77 ALDH1A1 (0.44)
SCHEMBL8520617 0.77 ALDH1A1 (0.39)
SCHEMBL8416103 0.76 ALDH1A1 (0.48) L3MBTL1
SCHEMBL8417328 0.75
SCHEMBL8414446 0.73
SCHEMBL1001872 0.69 RB1 (0.37) RB1TSHRL3MBTL1
SCHEMBL22417862 0.68 ALDH1A1 (0.52) RB1TSHRL3MBTL1
SCHEMBL4167168 0.67 KDM1A (0.31)
SCHEMBL26261022 0.66 ALDH1A1 (0.57) RB1TSHRL3MBTL1
SCHEMBL12385861 0.65 RB1 (0.35) RB1TSHRL3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0939760-A2 1-THIOGALACTOSE DERIVATIVES SYNSORB Biotech Inc. (CA) 1999-09-08 EP disclosed
EP-0937093-A2 1-GALACTOSE DERIVATIVES SYNSORB Biotech Inc. (CA) 1999-08-25 EP disclosed
WO-1998021222-A2 1-GALACTOSE DERIVATIVES SYNSORB BIOTECH, INC. (CA) 1998-05-22 WO disclosed
WO-1998021221-A2 1-THIOGALACTOSE DERIVATIVES SYNSORB BIOTECH, INC. (CA) 1998-05-22 WO disclosed