SCHEMBL28637340

SCHEMBL28637340

CC1(C)CCC(N2C(=O)C=CC2=O)CC1

nearest known ligand 0.34

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.32
POLB P06746 2/20 0.32
GSK3A P49840 1/20 0.32
GSK3B P49841 1/20 0.32
MGLL Q99685 1/20 0.32
MAPT P10636 2/20 0.31
LMNA P02545 2/20 0.31
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31
OPRM1 P35372 1/20 0.31
OPRL1 P41146 1/20 0.31
SRD5A2 P31213 1/20 0.31
GAA P10253 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
SCHEMBL29246382 0.82 CHRM2 (0.33)
SCHEMBL10900791 0.80 FFAR3 (0.43)
SCHEMBL209765 0.79 ALDH1A1 (0.46) ALDH1A1POLBGSK3AGSK3BMGLL
SCHEMBL3414903 0.79 ALDH1A1 (0.46) ALDH1A1POLBGSK3AGSK3BMGLL
SCHEMBL18209593 0.75 ALDH1A1 (0.48) ALDH1A1POLBMAPTLMNAKMT2A
SCHEMBL212347 0.75 ALDH1A1 (0.43) ALDH1A1POLBGSK3AGSK3BMGLL
SCHEMBL209046 0.75 ALDH1A1 (0.48) ALDH1A1POLBMAPTLMNAKMT2A
SCHEMBL348031 0.74 GMNN (0.31) ALDH1A1MGLLMAPTLMNA
SCHEMBL7226920 0.74 ALDH1A1 (0.39) ALDH1A1POLBGSK3AGSK3BMGLL
SCHEMBL15477998 0.74 ALDH1A1 (0.39) ALDH1A1POLBGSK3AGSK3BMGLL

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
CN-113515024-A Method for treating radiation-sensitive composition JSR株式会社 2021-10-19 CN disclosed