SCHEMBL28316693

SCHEMBL28316693

C1CC2CCC1C2.NON

nearest known ligand 0.32

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.32
SLC22A2 O15244 1/20 0.32
SLC22A1 O15245 1/20 0.32
GRIN2D O15399 1/20 0.32
GRIN3B O60391 1/20 0.32
TSHR P16473 1/20 0.32
NFKB1 P19838 1/20 0.32
STAT6 P42226 1/20 0.32
GRIN1 Q05586 1/20 0.32
GRIN2A Q12879 1/20 0.32
GRIN2B Q13224 1/20 0.32
GRIN2C Q14957 1/20 0.32
GRIN3A Q8TCU5 1/20 0.32
SLC47A1 Q96FL8 1/20 0.32
SIGMAR1 Q99720 1/20 0.32
POLB P06746 1/20 0.30
THRB P10828 1/20 0.30
BLM P54132 1/20 0.30
PMP22 Q01453 1/20 0.30
SMN1; SMN2 Q16637 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
SCHEMBL3226595 0.82 SLC22A2 (0.31) LMNASLC22A2SLC22A1GRIN2DGRIN3B
SCHEMBL1230616 0.82 SLC22A2 (0.31) LMNASLC22A2SLC22A1GRIN2DGRIN3B
SCHEMBL8189 0.82
Methylamine SCHEMBL10602332 0.78 SLC22A2 (0.33) LMNASLC22A2SLC22A1GRIN2DGRIN3B
Ammonia Solution, Strong SCHEMBL673260 0.77
SCHEMBL10952319 0.77
SCHEMBL23044817 0.77
SCHEMBL6344816 0.77
SCHEMBL6053187 0.77
Adamantane SCHEMBL2394879 0.77 CYP2C9 (0.38)

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-110088169-A Method for preparing polyetherimide 沙特基础工业全球技术有限公司 2019-08-02 CN disclosed