SCHEMBL1110552

SCHEMBL1110552

O=P(O)(O)OP(=O)(O)OCc1ccccc1

nearest known ligand 0.78

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.78
BTN3A1 O00481 1/20 0.55
SRC P12931 1/20 0.54
CETP P11597 3/20 0.50
PDPK1 O15530 2/20 0.50
MTOR P42345 1/20 0.50
FNTA P49354 1/20 0.50
FNTB P49356 1/20 0.50
AKR1C3 P42330 1/20 0.46
ALPG P10696 1/20 0.46
PTK2B Q14289 1/20 0.46
FOLH1 Q04609 1/20 0.44
ALDH1A1 P00352 1/20 0.41

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
SCHEMBL8933666 0.92 TSHR (0.84) TSHRBTN3A1SRCCETPPDPK1
Monoethanolamine SCHEMBL5459494 0.90 TSHR (0.64) TSHRBTN3A1SRCCETPPDPK1
SCHEMBL51316 0.88 TSHR (1.00) TSHRSRCCETPPDPK1MTOR
SCHEMBL27908642 0.88 TSHR (1.00) TSHRSRCCETPPDPK1MTOR
SCHEMBL6749263 0.87 TSHR (0.75) TSHRBTN3A1SRCCETPPDPK1
SCHEMBL4338628 0.86 TSHR (0.62) TSHRBTN3A1SRCCETPPDPK1
Hydrochloric Acid SCHEMBL10722992 0.86 TSHR (0.96) TSHRSRCCETPPDPK1MTOR
SCHEMBL9446520 0.86 TSHR (0.96) TSHRSRCCETPPDPK1MTOR
Ammonia Solution, Strong SCHEMBL7268743 0.86 TSHR (0.96) TSHRSRCCETPPDPK1MTOR
SCHEMBL4219700 0.86 TSHR (0.96) TSHRSRCCETPPDPK1MTOR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2011045817-A2 PROCESS FOR THE PREPARATION OF FOSAPREPITANT, INTERMEDIATE AND PHARMACEUTICAL ACCEPTABLE SALT THEREOF SANDOZ PRIVATE LIMITED (IN) 2011-04-21 WO claimed
EP-4733306-A1 NOVEL MODIFIED TRINUCLEOTIDE CAPPING DERIVATIVE, AND MRNA INTO WHICH CAPPING DERIVATIVE IS INTRODUCED Elonova Co., Ltd. (KR) 2026-04-29 EP disclosed
WO-2025129116-A1 COMPOUNDS FOR THE TARGETED DEGRADATION OF SMARCA2 C4 THERAPEUTICS, INC. (US) 2025-06-19 WO disclosed
WO-2025005647-A1 NOVEL MODIFIED TRINUCLEOTIDE CAPPING DERIVATIVE, AND MRNA INTO WHICH CAPPING DERIVATIVE IS INTRODUCED 전북대학교산학협력단 2025-01-02 WO disclosed
CN-119097698-A Inhibitors of mevalonate pathway as efficient vaccine adjuvants 清华大学 2024-12-10 CN disclosed
CN-114848656-B Inhibitors of mevalonate pathway as efficient vaccine adjuvants 清华大学 2024-09-27 CN disclosed
US-20240209010-A1 PRODRUGS OF AZO COMPOUNDS AND THEIR SALTS AMNEAL PHARMACEUTICALS LLC 2024-06-27 US disclosed
CN-113527386-B Intermediate of vaccine adjuvant MPLA, synthesis and application 上海医药工业研究院 2024-03-29 CN disclosed
CN-113527396-B Intermediate of vaccine adjuvant MPLA, synthesis and application 上海医药工业研究院 2024-02-02 CN disclosed
CN-113527397-B Intermediate of vaccine adjuvant MPLA, synthesis and application 上海医药工业研究院 2024-02-02 CN disclosed
US-20110130366-A1 FOSAPREPITANT DIMEGLUMINE INTERMEDIATE, NEUTRAL FOSAPREPITANT, AND AMORPHOUS FOSAPREPITANT DIMEGLUMINE AND PROCESSES FOR THEIR PREPARATIONS GLENMARK GENERICS LMITED (IN) 2011-06-02 US disclosed
WO-2011045817-A2 PROCESS FOR THE PREPARATION OF FOSAPREPITANT, INTERMEDIATE AND PHARMACEUTICAL ACCEPTABLE SALT THEREOF SANDOZ PRIVATE LIMITED (IN) 2011-04-21 WO disclosed
EP-2303901-A2 FOSAPREPITANT DIMEGLUMINE INTERMEDIATE, NEUTRAL FOSAPREPITANT, AND AMORPHOUS FOSAPREPITANT DIMEGLUMINE AND PROCESSES FOR THEIR PREPARATIONS Glenmark Generics Limited (IN) 2011-04-06 EP disclosed
EP-2279194-A1 UNNATURAL POLYMERASE SUBSTRATES THAT CAN SUSTAIN ENZYMATIC SYNTHESIS OF DOUBLE STRANDED NUCLEIC ACIDS FROM A NUCLEIC ACID TEMPLATE AND METHODS OF USE Life Technologies (US) 2011-02-02 EP disclosed
US-20100130489-A1 IMIDAZOLO-HETEROARYL DERIVATIVES WITH ANTIBACTERIAL PROPERTIES MUTABILIS SA (FR) 2010-05-27 US disclosed
EP-2155750-A2 NEW IMIDAZOLO-HETEROARYL DERIVATIVES WITH ANTIBACTERIAL PROPERTIES Mutabilis SA (FR) 2010-02-24 EP disclosed
WO-2010018595-A2 FOSAPREPITANT DIMEGLUMINE INTERMEDIATE, NEUTRAL FOSAPREPITANT, AND AMORPHOUS FOSAPREPITANT DIMEGLUMINE AND PROCESSES FOR THEIR PREPARATIONS GLENMARK GENERICS LIMITED (IN) 2010-02-18 WO disclosed
WO-2009134469-A1 UNNATURAL POLYMERASE SUBSTRATES THAT CAN SUSTAIN ENZYMATIC SYNTHESIS OF DOUBLE STRANDED NUCLEIC ACIDS FROM A NUCLEIC ACID TEMPLATE AND METHODS OF USE LIFE TECHNOLOGIES (US) 2009-11-05 WO disclosed
US-20090269759-A1 UNNATURAL POLYMERASE SUBSTRATES THAT CAN SUSTAIN ENZYMATIC SYNTHESIS OF DOUBLE STRANDED NUCLEIC ACIDS FROM A NUCLEIC ACID TEMPLATE AND METHODS OF USE LIFE TECHNOLOGIES (US) 2009-10-29 US disclosed
WO-2008117225-A2 NEW IMIDAZOLO-HETEROARYL DERIVATIVES WITH ANTIBACTERIAL PROPERTIES MUTABILIS SA (FR) 2008-10-02 WO 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 (4 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-20100130489-A1 IMIDAZOLO-HETEROARYL DERIVATIVES WITH ANTIBACTERIAL PROPERTIES DLAT, DLST, DNTT TSHR 3930/4885BTN3A1 2144/4885SRC 3992/4885
US-20110130366-A1 FOSAPREPITANT DIMEGLUMINE INTERMEDIATE, NEUTRAL FOSAPREPITANT, AND AMORPHOUS FOSAPREPITANT DIMEGLUMINE AND PROCESSES FOR THEIR PREPARATIONS HRH2, CMA1, TPSD1 TSHR 2944/4885BTN3A1 4561/4885SRC 4282/4885
US-20090269759-A1 UNNATURAL POLYMERASE SUBSTRATES THAT CAN SUSTAIN ENZYMATIC SYNTHESIS OF DOUBLE STRANDED NUCLEIC ACIDS FROM A NUCLEIC ACID TEMPLATE AND METHODS OF USE RNGTT, UNG, POLRMT TSHR 3849/4885BTN3A1 3175/4885SRC 4791/4885
US-20240209010-A1 PRODRUGS OF AZO COMPOUNDS AND THEIR SALTS CYP11B1, CYP2C19, CYP11B2 TSHR 3565/4885BTN3A1 4358/4885SRC 538/4885

“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.