SCHEMBL7053791

SCHEMBL7053791

C1COC1.C1COC1.O=P(O)(O)Cl.O=P(O)(O)Cl

nearest known ligand 0.43

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.43
MMP1 P03956 1/20 0.35
MMP3 P08254 1/20 0.35
MMP8 P22894 1/20 0.35
MEN1 O00255 1/20 0.31
TP53 P04637 1/20 0.31
KMT2A Q03164 1/20 0.31

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 SCHEMBL2256576 0.85 TSHR (0.50) TSHRMMP1MMP3MMP8MEN1
Phosphoric Acid SCHEMBL29167359 0.85
Phosphoric Acid SCHEMBL5159836 0.81 TSHR (0.46) TSHRMMP1MMP3MMP8MEN1
Fluoride SCHEMBL27793708 0.80
Tetrahydrofuran SCHEMBL28066456 0.80 ALDH1A1 (0.50) MMP1MMP3MMP8
SCHEMBL10889963 0.76
SCHEMBL123363 0.76
SCHEMBL7053793 0.74
Phosphoric Acid SCHEMBL5067196 0.72
Phosphoric Acid SCHEMBL28768412 0.72 TTR (0.42) TSHRMMP1MMP3MMP8

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0898557-B9 WATER SOLUBLE TRI-SUBSTITUTED 1,2-DIOXETANE COMPOUNDS HAVING INCREASED STORAGE STABILITY, SYNTHETIC PROCESSES AND INTERMEDIATES LUMIGEN INC (US) 2003-10-08 EP disclosed
EP-0898557-B1 WATER SOLUBLE TRI-SUBSTITUTED 1,2-DIOXETANE COMPOUNDS HAVING INCREASED STORAGE STABILITY, SYNTHETIC PROCESSES AND INTERMEDIATES LUMIGEN INC (US) 2003-04-23 EP disclosed
US-6410751-B1 GENERATING CHEMILUMINESCENCE LUMIGEN, INC. 2002-06-25 US disclosed
US-6353129-B1 CHEMILUMINESCENCE LUMIGEN, INC. 2002-03-05 US disclosed
US-20020019553-A1 Water soluble tri-substituted 1,2-dioxetane compounds having increased storage stability, synthetic processes and intermediates AKHAVAN-TAFTI HASHEM (US) 2002-02-14 US disclosed
US-6245928-B1 ALKENE COMPOUNDS USED AS SYNTHETIC INTERMEDIATES IN THE PROCESS OF PREPARING DIOXETANES; WHICH ARE CHEMILUMINESCENT AND CAN BE USED AS NON-POLYMERIC CATIONIC SURFACTANT ENHANCER OR FLUORESCER LUMIGEN, INC. 2001-06-12 US disclosed
US-6180833-B1 REACTING IN SOLVENT PRECURSOR VINYL ETHER WITH CATALYTIC AMOUNT OF MERCURY (II) SALT AND AT LEAST ONE MOLE EQUIVALENT OF ALCOHOL SELECTED FROM ALKANOLS, SUBSTITUTED ALKANOLS, BENZYL ALCOHOL AND UNSATURATED ALCOHOLS TO GIVE PRODUCT ETHER LUMIGEN, INC. 2001-01-30 US disclosed
EP-0898557-A4 WATER SOLUBLE TRI-SUBSTITUTED 1,2-DIOXETANE COMPOUNDS HAVING INCREASED STORAGE STABILITY, SYNTHETIC PROCESSES AND INTERMEDIATES LUMIGEN INC (US) 2001-01-10 EP disclosed
US-6036892-A ENZYMATICALLY TRIGGERED CHEMILUMINESCENT 1,2-DIOXETANES LUMIGEN, INC. (US) 2000-03-14 US disclosed
EP-0898557-A1 WATER SOLUBLE TRI-SUBSTITUTED 1,2-DIOXETANE COMPOUNDS HAVING INCREASED STORAGE STABILITY, SYNTHETIC PROCESSES AND INTERMEDIATES LUMIGEN, INC. (US) 1999-03-03 EP disclosed
WO-1998019989-A1 WATER SOLUBLE TRI-SUBSTITUTED 1,2-DIOXETANE COMPOUNDS HAVING INCREASED STORAGE STABILITY, SYNTHETIC PROCESSES AND INTERMEDIATES LUMIGEN, INC. (US) 1998-05-14 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 (1 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-20020019553-A1 Water soluble tri-substituted 1,2-dioxetane compounds having increased storage stability, synthetic processes and intermediates SMOX, FLAD1, FTO TSHR 1265/4885MMP1 1053/4885MMP3 2129/4885

“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.