SCHEMBL29136506

SCHEMBL29136506

O=C1CCC(=O)N1P(=O)(c1ccccc1)c1ccccc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PARL Q9H300 3/20 0.44
▸ CA2 P00918 1/20 0.39
▸ CA4 P22748 1/20 0.39
▸ CA5A P35218 1/20 0.39
▸ SMN1; SMN2 Q16637 1/20 0.38
▸ CFTR P13569 1/20 0.35
▸ MMP2 P08253 1/20 0.35
▸ CYP2D6 P10635 1/20 0.35
▸ CYP2C9 P11712 1/20 0.35
▸ TSHR P16473 1/20 0.35
▸ GAA P10253 2/20 0.35
▸ ALDH1A1 P00352 3/20 0.34
▸ L3MBTL1 Q9Y468 2/20 0.34
▸ TDP1 Q9NUW8 1/20 0.34
▸ MAPT P10636 1/20 0.34
▸ ALPG P10696 1/20 0.34
▸ ALOX12 P18054 1/20 0.34
▸ NPY1R P25929 1/20 0.34
▸ HTT P42858 1/20 0.34
▸ NPY2R P49146 1/20 0.34

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
SCHEMBL5543989 0.70 TSHR (0.45) CA2CA4CA5ACFTRCYP2D6
SCHEMBL29136527 0.69 PARL (0.46) PARLCA2CA4CA5ASMN1; SMN2
SCHEMBL17189114 0.65 BCHE (0.46) L3MBTL1
SCHEMBL17189020 0.65 P2RX4 (0.47) CA2CA4CA5ASMN1; SMN2MAPT
SCHEMBL11991117 0.65 CA2 (0.39) CA2CA4CA5ACFTRCYP2D6
SCHEMBL14420676 0.65 TSHR (0.49) CA2CA4CA5ACYP2D6CYP2C9
SCHEMBL9927204 0.64 GAA (0.38) CA2CA4CA5ACFTRTSHR
SCHEMBL6161536 0.63 SIGMAR1 (0.45) CYP2D6CYP2C9TSHRGAAALDH1A1
SCHEMBL370611 0.62 KMT2A (0.64) CA2SMN1; SMN2GAAALDH1A1L3MBTL1
Triphenylphosphine Oxide SCHEMBL3949 0.61 CA2 (0.58) CA2CA4CA5ACFTRTSHR

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-117362342-A Synthesis method of diaryl phosphorus-oxygen disubstituted succinimide compound 宜春学院 2024-01-09 — — CN disclosed
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