SCHEMBL21145337

SCHEMBL21145337

O=P([O-])([O-])OCC(O)CO.O=P([O-])([O-])OCC(O)CO.O=P([O-])([O-])OCC(O)CO.[In+3].[In+3]

nearest known ligand 0.51

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.51
LMNA P02545 3/20 0.35
ALDH1A1 P00352 1/20 0.35
KDM4E B2RXH2 1/20 0.32
DUSP3 P51452 1/20 0.32
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
USP2 O75604 1/20 0.31
PGK1 P00558 1/20 0.30
PGK2 P07205 1/20 0.30
LPAR5 Q9H1C0 1/20 0.30

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
SCHEMBL124155 0.98 SMN1; SMN2 (0.53) SMN1; SMN2LMNAALDH1A1KDM4EDUSP3
SCHEMBL4450401 0.98 SMN1; SMN2 (0.53) SMN1; SMN2LMNAALDH1A1KDM4EDUSP3
SCHEMBL16567918 0.98 SMN1; SMN2 (0.53) SMN1; SMN2LMNAALDH1A1KDM4EDUSP3
SCHEMBL7635668 0.95 SMN1; SMN2 (0.51) SMN1; SMN2LMNAALDH1A1KDM4EDUSP3
SCHEMBL21752929 0.95 SMN1; SMN2 (0.51) SMN1; SMN2LMNAALDH1A1KDM4EDUSP3
SCHEMBL21752847 0.95 SMN1; SMN2 (0.51) SMN1; SMN2LMNAALDH1A1KDM4EDUSP3
SCHEMBL21145174 0.95 SMN1; SMN2 (0.51) SMN1; SMN2LMNAALDH1A1KDM4EDUSP3
SCHEMBL15271354 0.95 SMN1; SMN2 (0.51) SMN1; SMN2LMNAALDH1A1KDM4EDUSP3
SCHEMBL7634708 0.95 SMN1; SMN2 (0.51) SMN1; SMN2LMNAALDH1A1KDM4EDUSP3
Water SCHEMBL2477276 0.95 SMN1; SMN2 (0.51) SMN1; SMN2LMNAALDH1A1KDM4EDUSP3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3996662-A1 METHODS AND COMPOSITIONS TO INCREASE THE HARDNESS AND RESISTANCE OF ENAMEL The Procter & Gamble Company (US) 2022-05-18 EP disclosed
CN-114173747-A Method and composition for improving enamel hardness and resistance 宝洁公司 2022-03-11 CN disclosed
WO-2021007196-A1 METHODS AND COMPOSITIONS TO INCREASE THE HARDNESS AND RESISTANCE OF ENAMEL THE PROCTER & GAMBLE COMPANY (US) 2021-01-14 WO disclosed
US-20210007948-A1 Methods And Compositions To Increase The Hardness And Resistance Of Enamel THE PROCTER & GAMBLE COMPANY 2021-01-14 US disclosed
EP-3740184-A1 METHODS AND COMPOSITIONS TO INCREASE THE HARDNESS AND RESISTANCE OF ENAMEL The Procter & Gamble Company (US) 2020-11-25 EP disclosed
CN-111615378-A Method and composition for improving enamel hardness and resistance 宝洁公司 2020-09-01 CN disclosed
US-10588833-B2 Methods and compositions to increase the hardness and resistance of enamel THE PROCTER & GAMBLE COMPANY (US) 2020-03-17 US disclosed
WO-2019143746-A1 METHODS AND COMPOSITIONS TO INCREASE THE HARDNESS AND RESISTANCE OF ENAMEL THE PROCTER & GAMBLE COMPANY (US) 2019-07-25 WO disclosed
US-20190216693-A1 Methods And Compositions TO Increase The Hardness And Resistance of Enamel THE PROCTER & GAMBLE COMPANY 2019-07-18 US 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-20190216693-A1 Methods And Compositions TO Increase The Hardness And Resistance of Enamel CHD3, CHD9, CHD1 SMN1; SMN2 2809/4885LMNA 639/4885ALDH1A1 4121/4885

“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.