SCHEMBL1305142

SCHEMBL1305142

CC(C)(C)c1ccc([PH](=O)c2ccc(C(C)(C)C)cc2)cc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.48
LMNA P02545 1/20 0.46
TYR P14679 1/20 0.46
ALDH1A1 P00352 5/20 0.43
HDAC1 Q13547 1/20 0.41
SRD5A2 P31213 1/20 0.40
KIF11 P52732 2/20 0.39
CYP1A2 P05177 1/20 0.39
CA1 P00915 1/20 0.39
CA2 P00918 1/20 0.39
CA9 Q16790 1/20 0.39
NPC1 O15118 2/20 0.37
MAPT P10636 2/20 0.37
RAB9A P51151 2/20 0.37
HPGD P15428 2/20 0.37
MAPK1 P28482 1/20 0.37
SLC22A2 O15244 1/20 0.37
SLC22A1 O15245 1/20 0.37
SLC22A3 O75751 1/20 0.37
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
SCHEMBL2154718 0.91 L3MBTL1 (0.42) TSHRLMNATYRALDH1A1SRD5A2
SCHEMBL13715604 0.85 CYP2D6 (0.43) TSHRLMNATYRALDH1A1HIF1A
SCHEMBL14246524 0.80 TSHR (0.44) TSHRLMNATYRALDH1A1HDAC1
SCHEMBL8386750 0.80 LMNA (0.48) TSHRLMNATYRALDH1A1HDAC1
SCHEMBL424728 0.76 TSHR (0.73) TSHRLMNATYRALDH1A1HDAC1
SCHEMBL16241997 0.75 TSHR (0.55) TSHRLMNATYRALDH1A1HDAC1
SCHEMBL1305234 0.74 GABRA1 (0.46) TSHRALDH1A1NPC1MAPTRAB9A
SCHEMBL6933048 0.74 CES2 (0.46) TSHRALDH1A1SRD5A2KIF11CYP1A2
SCHEMBL4320820 0.73 CA1 (0.44) TSHRLMNATYRALDH1A1CA1
SCHEMBL2154623 0.72 HDAC8 (0.43) ALDH1A1KIF11NPC1MAPTRAB9A

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 66 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117143150-A Preparation method of chiral 2-hydroxyphosphinic oxide and derivative thereof 广西大学 2023-12-01 CN claimed
CN-120004942-A Method for synthesizing phosphorothioate compound by using manganese acetate dihydrate 苏州大学 2025-05-16 CN disclosed
CN-117164627-B Ketone phosphine oxide compound containing trifluoromethyl quaternary carbon center, preparation method and application thereof 南京工业大学 2025-04-22 CN disclosed
CN-115403623-B Method for preparing 2-pyrrolyl substituted phosphine oxide compound 湖南理工学院 2024-10-29 CN disclosed
CN-118652272-A Method for synthesizing thiophosphorus/phosphinic acid ester compound 中国人民解放军军事科学院防化研究院 2024-09-17 CN disclosed
CN-114805430-B Preparation method of selenophosphide and thiophosphoride 烟台大学 2024-02-13 CN disclosed
CN-117164627-A Ketone phosphine oxide compound containing trifluoromethyl quaternary carbon center, preparation method and application thereof 南京工业大学 2023-12-05 CN disclosed
CN-117143150-A Preparation method of chiral 2-hydroxyphosphinic oxide and derivative thereof 广西大学 2023-12-01 CN disclosed
CN-116695147-A Electrochemical synthesis method of phenylethynyl phosphine oxide derivative 上海兆维科技发展有限公司 2023-09-05 CN disclosed
CN-115572310-A Preparation method of alpha, alpha-disubstituted-gamma-ketophosphine oxide 西北民族大学 2023-01-06 CN disclosed
US-20070161805-A1 Phosphine-borane complex enantiomorph compounds produced in solvents and in the presence of nickel catalysts; useful for asymmetric synthesis of compounds useful as drug for prophylaxis or treatment of increased urinary frequency or urinary incontinence, Alzheimer's disease SPERA PHARMA, INC. (JP) 2007-07-12 US disclosed
US-20070161805-A1 Phosphine-borane complex enantiomorph compounds produced in solvents and in the presence of nickel catalysts; useful for asymmetric synthesis of compounds useful as drug for prophylaxis or treatment of increased urinary frequency or urinary incontinence, Alzheimer's disease SPERA PHARMA, INC. (JP) 2007-07-12 US disclosed
US-7208633-B2 Process for preparation of diphosphine compounds and intermediates for the process TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2007-04-24 US disclosed
US-7208633-B2 Process for preparation of diphosphine compounds and intermediates for the process TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2007-04-24 US disclosed
US-7208633-B2 Process for preparation of diphosphine compounds and intermediates for the process TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2007-04-24 US disclosed
US-20050027124-A1 Process for preparation of diphosphine compounds and intermediates for the process SPERA PHARMA, INC. (JP) 2005-02-03 US disclosed
EP-1452537-A1 PROCESS FOR PREPARATION OF DIPHOSPHINE COMPOUNDS AND INTERMEDIATES FOR THE PROCESS Takeda Chemical Industries, Ltd. (JP) 2004-09-01 EP disclosed
US-6730629-B2 HYDROGENATION CATALYST TAKASAGO INTERNATIONAL CORPORATION (JP) 2004-05-04 US disclosed
US-20030139285-A1 Novel asymmetric phosphine ligand TAKASAGO INTERNATIONAL CORPORATION (JP) 2003-07-24 US disclosed
EP-1318156-A1 Novel asymmetric phosphine ligand Takasago International Corporation (JP) 2003-06-11 EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (3 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20070161805-A1 Phosphine-borane complex enantiomorph compounds produced in solvents and in the presence of nickel catalysts; useful for asymmetric synthesis of compounds useful as drug for prophylaxis or treatment of increased urinary frequency or urinary incontinence, Alzheimer's disease BACE1, H1-10, PRMT1 TSHR 1972/4885LMNA 2776/4885TYR 4124/4885
US-20050027124-A1 Process for preparation of diphosphine compounds and intermediates for the process H1-10, ITPA, RER1 TSHR 1089/4885LMNA 2061/4885TYR 1367/4885
US-20030139285-A1 Novel asymmetric phosphine ligand PHOSPHO1, PAPSS1, PPM1F TSHR 2674/4885LMNA 4820/4885TYR 3410/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.