SCHEMBL1491912

SCHEMBL1491912

OCCC(O)OB(O)c1ccccc1

nearest known ligand 0.37

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ORAI1 Q96D31 3/20 0.37
ORAI2 Q96SN7 3/20 0.37
ORAI3 Q9BRQ5 3/20 0.37
TRPV6 Q9H1D0 3/20 0.37
PCSK9 Q8NBP7 2/20 0.37
CA4 P22748 1/20 0.37
CA6 P23280 1/20 0.37
CA5A P35218 1/20 0.37
CA7 P43166 1/20 0.37
ENPP2 Q13822 1/20 0.37
CA14 Q9ULX7 1/20 0.37
CA5B Q9Y2D0 1/20 0.37
TDP1 Q9NUW8 1/20 0.34
TRPA1 O75762 1/20 0.33
LMNA P02545 1/20 0.32
ALDH1A1 P00352 3/20 0.31
RECQL P46063 1/20 0.31
GAA P10253 1/20 0.31
SMN1; SMN2 Q16637 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
SCHEMBL1808634 0.80 KDM4E (0.35) LMNASMN1; SMN2
SCHEMBL5952291 0.76 CA4 (0.32) ORAI1ORAI2ORAI3TRPV6PCSK9
SCHEMBL841741 0.73 ESR2 (0.32) SMN1; SMN2
Phenylboronic Acid SCHEMBL28466255 0.72 ENPP2 (0.54) ORAI1ORAI2ORAI3TRPV6PCSK9
SCHEMBL10797953 0.71 TDP1 (0.37) ORAI1ORAI2ORAI3TRPV6PCSK9
SCHEMBL15570627 0.70 TRPV6 (0.44) ORAI1ORAI2ORAI3TRPV6PCSK9
SCHEMBL1226528 0.70 TRPV6 (0.44) ORAI1ORAI2ORAI3TRPV6PCSK9
SCHEMBL28423595 0.69 ENPP2 (0.39) ORAI1ORAI2ORAI3TRPV6PCSK9
SCHEMBL2569853 0.68 ALDH1A1 (0.45) TDP1TRPA1LMNAALDH1A1RECQL
Benzene SCHEMBL10445518 0.68 ALDH1A1 (0.45) ORAI1ORAI2ORAI3TRPV6PCSK9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20180269528-A1 ELECTROLYTE FOR LTO TYPE LITHIUM ION BATTERIES SHENZHEN CAPCHEM TECHNOLOGY CO., LTD (CN) 2018-09-20 US claimed
US-20170317385-A1 Electrolyte Compositions For Rechargeable Lithium Ion Batteries BASF CORPORATION (US) 2017-11-02 US claimed
EP-2499181-B1 POLYMER FOR OPTOELECTRONIC DEVICE BOE TECHNOLOGY GROUP CO LTD (CN) 2020-05-13 EP disclosed
US-20180269528-A1 ELECTROLYTE FOR LTO TYPE LITHIUM ION BATTERIES SHENZHEN CAPCHEM TECHNOLOGY CO., LTD (CN) 2018-09-20 US disclosed
US-20170317385-A1 Electrolyte Compositions For Rechargeable Lithium Ion Batteries BASF CORPORATION (US) 2017-11-02 US disclosed
US-20150315127-A1 THERAPEUTIC COMPOUNDS UNIVERSITY OF FLORIDA RESEARCH FOUNDATION, INC. 2015-11-05 US disclosed
US-8512879-B2 Polymer for optoelectronic device GENERAL ELECTRIC COMPANY (US) 2013-08-20 US disclosed
EP-2499181-A1 POLYMER FOR OPTOELECTRONIC DEVICE General Electric Company (US) 2012-09-19 EP disclosed
WO-2011059553-A1 POLYMER FOR OPTOELECTRONIC DEVICE GENERAL ELECTRIC COMPANY (US) 2011-05-19 WO disclosed
US-20110108807-A1 POLYMER FOR OPTOELECTRONIC DEVICE GENERAL ELECTRIC COMPANY (US) 2011-05-12 US disclosed
WO-2011041025-A1 POLYMER AND OPTOELECTRONIC DEVICE COMPRISING THE SAME GENERAL ELECTRIC COMPANY (US) 2011-04-07 WO disclosed
US-20110077373-A1 POLYMER AND OPTOELECTRONIC DEVICE COMPRISING THE SAME GENERAL ELECTRIC COMPANY (US) 2011-03-31 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-20150315127-A1 THERAPEUTIC COMPOUNDS HTR2C, GRK2, GRK3 ORAI1 2016/4885ORAI2 1465/4885ORAI3 1657/4885

“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.