SCHEMBL28909158

SCHEMBL28909158

O=S(=O)(O)c1ccc(-c2ccc(N=NO)cc2)cc1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ POLB P06746 1/20 0.60
▸ CYP2D6 P10635 1/20 0.60
▸ MEN1 O00255 2/20 0.46
▸ KMT2A Q03164 2/20 0.46
▸ RPS6KA3 P51812 1/20 0.46
▸ LMNA P02545 1/20 0.45
▸ PHLPP2 Q6ZVD8 3/20 0.44
▸ CYP2C9 P11712 1/20 0.43
▸ CYP2C19 P33261 1/20 0.43
▸ HSD17B10 Q99714 1/20 0.43
▸ TSHR P16473 2/20 0.43
▸ ALDH1A1 P00352 2/20 0.43
▸ NT5E P21589 1/20 0.43
▸ SMN1; SMN2 Q16637 1/20 0.41
▸ CA12 O43570 2/20 0.40
▸ CA2 P00918 2/20 0.40
▸ CA9 Q16790 2/20 0.40
▸ CA7 P43166 1/20 0.40
▸ ATIC P31939 1/20 0.40
▸ TDP1 Q9NUW8 2/20 0.39

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
SCHEMBL28003469 0.94 POLB (0.67) POLBCYP2D6MEN1KMT2ARPS6KA3
SCHEMBL28235215 0.92 POLB (0.64) POLBCYP2D6MEN1KMT2ARPS6KA3
SCHEMBL28560987 0.83 POLB (0.83) POLBCYP2D6MEN1KMT2ARPS6KA3
SCHEMBL18624977 0.83 POLB (0.83) POLBCYP2D6MEN1KMT2ARPS6KA3
SCHEMBL3171676 0.80 LMNA (0.65) POLBCYP2D6LMNAHSD17B10TSHR
SCHEMBL525918 0.80 LMNA (0.65) POLBCYP2D6LMNAHSD17B10TSHR
SCHEMBL29990536 0.80 LMNA (0.65) POLBCYP2D6LMNAHSD17B10TSHR
SCHEMBL447639 0.80 LMNA (0.65) POLBCYP2D6LMNAHSD17B10TSHR
SCHEMBL9302668 0.78 LMNA (0.62) POLBCYP2D6LMNAHSD17B10TSHR
Ammonia Solution, Strong SCHEMBL10589724 0.78 LMNA (0.62) POLBCYP2D6LMNAHSD17B10TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115873186-A Preparation method and application of phthalate imprinting material 江苏大学 2023-03-31 — — CN disclosed
CN-112300347-B Preparation method and application of magnetic ferroferric oxide nanoparticle-based photoresponse imprinted material 江苏大学 2022-05-20 — — CN disclosed
CN-112300347-A Preparation method and application of magnetic ferroferric oxide nanoparticle-based photoresponse imprinted material 江苏大学 2021-02-02 — — CN disclosed
Send feedback