SCHEMBL29144993

SCHEMBL29144993

O=P(Cl)(OC12CC3CC(CC(C3)C1)C2)OC12CC3CC(CC(C3)C1)C2

nearest known ligand 0.61

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
NPSR1 Q6W5P4 1/20 0.61
GAA P10253 1/20 0.39
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
SLC22A2 O15244 1/20 0.31
SLC22A1 O15245 1/20 0.31
GRIN2D O15399 1/20 0.31
GRIN3B O60391 1/20 0.31
LMNA P02545 1/20 0.31
TSHR P16473 1/20 0.31
NFKB1 P19838 1/20 0.31
STAT6 P42226 1/20 0.31
GRIN1 Q05586 1/20 0.31
GRIN2A Q12879 1/20 0.31
GRIN2B Q13224 1/20 0.31
GRIN2C Q14957 1/20 0.31
GRIN3A Q8TCU5 1/20 0.31
SLC47A1 Q96FL8 1/20 0.31
SIGMAR1 Q99720 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
SCHEMBL27847768 0.89 NPSR1 (0.55) NPSR1GAAMEN1KMT2A
SCHEMBL4749836 0.80 NPSR1 (0.67) NPSR1GAAMEN1KMT2ASLC22A2
SCHEMBL6860823 0.77 NPSR1 (0.47) NPSR1GAAMEN1KMT2ASLC22A2
SCHEMBL4749839 0.76 NPSR1 (0.61) NPSR1GAAMEN1KMT2ASLC22A2
SCHEMBL17169179 0.76 NPSR1 (0.61) NPSR1GAAMEN1KMT2ASLC22A2
SCHEMBL19798472 0.73 NPSR1 (0.69) NPSR1GAAMEN1KMT2ATSHR
SCHEMBL28368315 0.71 NPSR1 (0.61) NPSR1GAAMEN1KMT2ALMNA
SCHEMBL4922662 0.70 NPSR1 (0.53) NPSR1GAAMEN1KMT2A
SCHEMBL906786 0.69 NPSR1 (0.52) NPSR1GAATSHR
SCHEMBL28945078 0.67 NPSR1 (0.55) NPSR1GAAMEN1KMT2A

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-117467255-A Polylactic acid composition with high flame retardance and crystallinity and preparation method thereof 江苏康辉新材料科技有限公司 2024-01-30 CN claimed
CN-117466936-A Bio-based flame-retardant nucleation additive for polyester and preparation method thereof 江苏康辉新材料科技有限公司 2024-01-30 CN claimed