SCHEMBL31406993

SCHEMBL31406993

C1CC23CC4CC1CC(CC(C4)C2)C3

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GRIN2D O15399 5/20 0.38
GRIN3B O60391 5/20 0.38
GRIN1 Q05586 5/20 0.38
GRIN2A Q12879 5/20 0.38
GRIN2B Q13224 5/20 0.38
GRIN2C Q14957 5/20 0.38
GRIN3A Q8TCU5 5/20 0.38
LMNA P02545 2/20 0.38
SLC22A2 O15244 2/20 0.38
SLC47A1 Q96FL8 2/20 0.38
SLC22A1 O15245 1/20 0.38
TSHR P16473 1/20 0.38
NFKB1 P19838 1/20 0.38
STAT6 P42226 1/20 0.38
SIGMAR1 Q99720 1/20 0.38
POLB P06746 1/20 0.36
THRB P10828 1/20 0.36
BLM P54132 1/20 0.36
PMP22 Q01453 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36

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
SCHEMBL31407001 0.73 GRIN2D (0.42) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL4948790 0.71 PKM (0.39) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL13556104 0.71 GRIN2D (0.63) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
Hydrochloric Acid SCHEMBL6085232 0.69 LMNA (0.65) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL13766183 0.66 GRIN2D (0.68) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL24846052 0.64 ALDH1A1 (0.47) ALDH1A1HTTNPSR1
SCHEMBL20952430 0.64 ALDH1A1 (0.47) THRBALDH1A1HTTNPSR1
SCHEMBL136714 0.62
SCHEMBL23926890 0.62
SCHEMBL963771 0.60 GRIN2D (0.50) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119505962-A Self-initiated high-power high-energy liquid fuel and preparation method thereof 中国人民解放军军事科学院系统工程研究院 2025-02-25 CN disclosed
CN-119193204-A High-energy liquid fuel system containing transition metal organic complex and preparation method thereof 中国人民解放军军事科学院系统工程研究院 2024-12-27 CN disclosed