SCHEMBL28443365

SCHEMBL28443365

O=[P](Cc1ccccc1)c1ccccc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.40
CYP3A4 P08684 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
CALM1 P0DP23 1/20 0.39
EPHX2 P34913 1/20 0.37
CES2 O00748 1/20 0.37
CES1 P23141 1/20 0.37
AKR1B1 P15121 1/20 0.37
FFAR1 O14842 1/20 0.37
ALDH1A1 P00352 2/20 0.36
IDO1 P14902 1/20 0.36
TP53 P04637 1/20 0.36
LOXL2 Q9Y4K0 1/20 0.36
TRPA1 O75762 1/20 0.36
MAOB P27338 3/20 0.36
MAOA P21397 2/20 0.36
FNTA P49354 1/20 0.35
FNTB P49356 1/20 0.35
HPGD P15428 1/20 0.35
ALOX15 P16050 1/20 0.35

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
Phosphoric Acid SCHEMBL28671898 0.89 TSHR (0.42) TSHRHPGD
SCHEMBL8156353 0.82 LTA4H (0.55) CES2CES1IDO1TP53
SCHEMBL1321 0.78 CALM1 (0.47) TSHRCALM1EPHX2CES2CES1
SCHEMBL30986892 0.75 TSHR (0.45) TSHRCALM1AKR1B1MAOB
SCHEMBL230856 0.74 TDP1 (0.43) TSHRCYP3A4TDP1CALM1ALDH1A1
SCHEMBL4827020 0.74 CYP3A4 (0.43) TSHRCYP3A4TDP1CALM1ALDH1A1
SCHEMBL27587243 0.74 TDP1 (0.43) TSHRCYP3A4TDP1ALDH1A1TRPA1
SCHEMBL4250554 0.74 TDP1 (0.43) TSHRCYP3A4TDP1CALM1EPHX2
SCHEMBL27614041 0.73 CYP3A4 (0.38) CYP3A4TDP1
Hydrochloric Acid SCHEMBL10899109 0.72 CYP3A4 (0.41) TSHRCYP3A4TDP1CALM1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113583042-B Preparation method of phosphoryl fluoride compound 烟台大学 2023-08-29 CN claimed
CN-113583042-A Preparation method of phosphoryl fluoride compound 烟台大学 2021-11-02 CN claimed
CN-120025371-A Preparation method of phosphorus-containing nitrogen heterocyclic compound 河北科技大学 2025-05-23 CN disclosed
CN-119075972-A MoO reinforced by radio frequency plasma technology3/g-C3N4Catalyst and application of catalyst in phosphonation reaction 中国人民解放军军事科学院防化研究院 2024-12-06 CN disclosed
CN-118126082-A Chiral phosphorus compound and preparation method and application thereof 四川大学 2024-06-04 CN disclosed
CN-113583042-B Preparation method of phosphoryl fluoride compound 烟台大学 2023-08-29 CN disclosed
CN-113583042-A Preparation method of phosphoryl fluoride compound 烟台大学 2021-11-02 CN disclosed
CN-111574564-A Fluoroalkyl-substituted furyl diphosphine oxygen compound and preparation method thereof 南京工业大学 2020-08-25 CN disclosed
CN-111560038-A Fluoroalkyl-substituted furyl monophosphine oxide compound and preparation method thereof 南京工业大学 2020-08-21 CN disclosed
CN-106471074-A Methods and processes for applying drug delivery polymer coatings 阿里斯特医疗公司 2017-03-01 CN disclosed