SCHEMBL24818643

SCHEMBL24818643

CC(C)CN[C@H]1CC[C@H]1O

nearest known ligand 0.35

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
GLB1 P16278 1/20 0.35
HTT P42858 1/20 0.34
EPHX1 P07099 1/20 0.33
CYP2D6 P10635 1/20 0.31
CYP2C19 P33261 1/20 0.31

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
SCHEMBL24818644 1.00 GLB1 (0.35) GLB1HTTEPHX1CYP2D6CYP2C19
SCHEMBL24818651 1.00 GLB1 (0.35) GLB1HTTEPHX1CYP2D6CYP2C19
SCHEMBL24819155 1.00 GLB1 (0.35) GLB1HTTEPHX1CYP2D6CYP2C19
SCHEMBL24819138 1.00 GLB1 (0.35) GLB1HTTEPHX1CYP2D6CYP2C19
SCHEMBL24819140 0.86 HTT (0.40) GLB1HTTEPHX1
SCHEMBL24820161 0.86 HTR1A (0.36) GLB1HTTEPHX1
SCHEMBL24819149 0.86 HTT (0.40) GLB1HTTEPHX1
SCHEMBL24819131 0.86 HTT (0.40) GLB1HTTEPHX1
SCHEMBL24819143 0.86 HTT (0.40) GLB1HTTEPHX1
SCHEMBL24842080 0.86 HTR1A (0.36) GLB1HTTEPHX1

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
WO-2022272248-A1 CBL-B MODULATORS AND USES THEREOF NIMBUS CLIO, INC. (US) 2022-12-29 WO disclosed