SCHEMBL2149479

SCHEMBL2149479

O=P(O)(O)OC1CCCC1

nearest known ligand 0.52

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
INPP5A Q14642 3/20 0.52
ACHE P22303 1/20 0.46
SMPD1 P17405 1/20 0.42
ITPR3 Q14573 7/20 0.40
ITPR2 Q14571 3/20 0.40
ITPR1 Q14643 3/20 0.40
INPPL1 O15357 1/20 0.39
AKT1 P31749 1/20 0.39
NPSR1 Q6W5P4 1/20 0.38
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38

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
SCHEMBL15105636 0.97 INPP5A (0.50) INPP5AACHESMPD1ITPR3ITPR2
SCHEMBL14412710 0.97 INPP5A (0.50) INPP5AACHESMPD1ITPR3ITPR2
SCHEMBL7041102 0.97 INPP5A (0.50) INPP5AACHESMPD1ITPR3ITPR2
SCHEMBL342838 0.97 INPP5A (0.50) INPP5AACHESMPD1ITPR3ITPR2
SCHEMBL15106222 0.97 INPP5A (0.50) INPP5AACHESMPD1ITPR3ITPR2
Phosphoric Acid SCHEMBL25174141 0.95 INPP5A (0.48) INPP5AACHESMPD1ITPR3ITPR2
SCHEMBL10768790 0.95 INPP5A (0.48) INPP5AACHESMPD1ITPR3ITPR2
Ammonia Solution, Strong SCHEMBL27537879 0.95 INPP5A (0.48) INPP5AACHESMPD1ITPR3ITPR2
SCHEMBL27281023 0.95 INPP5A (0.48) INPP5AACHESMPD1ITPR3ITPR2
Ammonia Solution, Strong SCHEMBL28814571 0.95 INPP5A (0.48) INPP5AACHESMPD1ITPR3ITPR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114181250-A Alkenyl phosphine compound and preparation method thereof 中国石油化工股份有限公司 2022-03-15 CN claimed
CN-1148374-C Phosphorous alicyclic epoxy compound and its prepn 中国科学院化学研究所 2004-05-05 CN claimed
CN-1403465-A Phosphorous alicyclic epoxy compound and its prepn CHINESE ACAD INST CHEMISTRY (CN) 2003-03-19 CN claimed
JP-54135753-A None JP disclosed
EP-3870285-B1 SYNTHESIS OF ESUBERAPROST PRODRUGS UNITED THERAPEUTICS CORP (US) 2025-06-18 EP disclosed
US-20240287105-A1 TREPROSTINIL ANALOGS AND RELATED METHODS OF MAKING AND USING UNITED THERAPEUTICS CORPORATION (US) 2024-08-29 US disclosed
CN-117281745-A Whitening essence emulsion containing III type collagen and preparation method of whitening essence emulsion 广东菲塔赫医药生物科技有限公司 2023-12-26 CN disclosed
CN-115010992-A Phosphorus-containing flame retardant and synthesis and application thereof 威海海润新材料科技有限公司 2022-09-06 CN disclosed
CN-114181250-A Alkenyl phosphine compound and preparation method thereof 中国石油化工股份有限公司 2022-03-15 CN disclosed
EP-2803408-B1 Method and apparatus for producing oxide of hydrocarbon compound using same UBE INDUSTRIES (JP) 2020-11-04 EP disclosed
CN-106165175-B High molecular electrolyte composition and polyelectrolyte membrane, film electrode composite element and the polymer electrolyte fuel cell for using it 东丽株式会社 2019-11-08 CN disclosed
US-20100075154-A1 POLYMERIZABLE COMPOSITION FOR OPTICAL MATERIAL, OPTICAL MATERIAL, AND METHOD FOR PREPARING THE OPTICAL MATERIAL MITSUI CHEMICALS, INC. (JP) 2010-03-25 US disclosed
US-7037691-B2 Kinase mimic catalysts for asymmetric synthesis of phosphorylated inositols and cycloalkanols THE TRUSTEES OF BOSTON COLLEGE (US) 2006-05-02 US disclosed
US-20050267291-A1 Kinase mimic catalysts for asymmetric synthesis of phosphorylated inositols and cycloalkanols THE TRUSTEES OF BOSTON COLLEGE 2005-12-01 US disclosed
CN-1148374-C Phosphorous alicyclic epoxy compound and its prepn 中国科学院化学研究所 2004-05-05 CN disclosed
US-20030100090-A1 Kinase mimic catalysts for asymmetric synthesis of phosphorylated insitols and cycloalkanols THE TRUSTEES OF BOSTON COLLEGE 2003-05-29 US disclosed
CN-1403465-A Phosphorous alicyclic epoxy compound and its prepn CHINESE ACAD INST CHEMISTRY (CN) 2003-03-19 CN disclosed
WO-2003004141-A2 KINASE MIMIC CATALYSTS FOR ASYMMETRIC SYNTHESIS OF PHOSPHORYLATED INSITOLS AND CYCLOALKANOLS THE TRUSTEES OF BOSTON COLLEGE (US) 2003-01-16 WO disclosed
US-5922654-A TWO OR MORE ORGANOMETALLIC COMPOUNDS WHERE THE METAL IS A TRANSITION METAL OR SEMIMETAL, OR ZINC; FOR EXAMPLE, ZINC DIALKYLDITHIOPHOSPHATE, OR NICKEL DIALKYLDITHIOCARBAMATE; HIGHER LOAD BEARING PROPERTIES, HIGH TEMPERATURE PERFORMANCE NSK LTD. (JP) 1999-07-13 US disclosed
JP-S54135753-A ORGANIC CYCLOPENTYL PHOSPHATE DERIVATIVE, ITS PREPARATION, AND AGRICULTURAL AND HORTICULTURAL FUNGICIDES COMPRISING IT AS ACTIVE CONSTITUENT NIPPON TOKUSHU NOYAKU SEIZO KK 1979-10-22 JP 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 (2 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-20240287105-A1 TREPROSTINIL ANALOGS AND RELATED METHODS OF MAKING AND USING TYMP, TTPA, PTGIS INPP5A 1837/4885ACHE 2531/4885SMPD1 187/4885
US-20050267291-A1 Kinase mimic catalysts for asymmetric synthesis of phosphorylated inositols and cycloalkanols IPMK, DMPK, IP6K1 INPP5A 152/4885ACHE 1059/4885SMPD1 534/4885

“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.