SCHEMBL31470101

SCHEMBL31470101

CCc1cc(CC)c(N(CC)CC)c(CC)c1

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSPA5 P11021 1/20 0.34
GRIN2D O15399 1/20 0.33
GRIN3B O60391 1/20 0.33
GRIN1 Q05586 1/20 0.33
GRIN2A Q12879 1/20 0.33
GRIN2B Q13224 1/20 0.33
GRIN2C Q14957 1/20 0.33
GRIN3A Q8TCU5 1/20 0.33
MEN1 O00255 1/20 0.33
GAA P10253 1/20 0.33
KMT2A Q03164 1/20 0.33
PTGS2 P35354 1/20 0.32
ALDH1A1 P00352 1/20 0.31
ALDH3A1 P30838 1/20 0.31
ALDH1A3 P47895 1/20 0.31
BACE1 P56817 1/20 0.31
RXRA P19793 1/20 0.31
RXRB P28702 1/20 0.31
TSHR P16473 1/20 0.30
CNR2 P34972 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
SCHEMBL27908301 0.79 HSPA5 (0.37) HSPA5MEN1GAAKMT2APTGS2
SCHEMBL3214261 0.78 PTGS2 (0.38) HSPA5GRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL10399130 0.73 GABRA1 (0.48) MEN1KMT2AALDH1A1ALDH3A1ALDH1A3
SCHEMBL11723756 0.70 ALDH1A3 (0.30) ALDH1A3
SCHEMBL19960883 0.70 ALDH1A1 (0.41) MEN1GAAKMT2APTGS2ALDH1A1
SCHEMBL2228767 0.69 HSPA5 (0.39) HSPA5GRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL18244029 0.69 HSPA5 (0.39) HSPA5GRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL1760666 0.69 DHFR (0.44) HSPA5GRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL23838393 0.67 HSPA5 (0.38) HSPA5GRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL6003047 0.67 HSPA5 (0.38) HSPA5GRIN2DGRIN3BGRIN1GRIN2A

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-119497711-A Photoinitiators, compositions and methods for forming objects 二次3D股份有限公司 2025-02-21 CN disclosed