SCHEMBL3637307

SCHEMBL3637307

O=C(O)/C=C/c1cc(CO)ccc1CO

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EGFR P00533 1/20 1.00
PTGER3 P43115 7/20 0.46
PTGER2 P43116 6/20 0.46
PTGDR Q13258 5/20 0.46
TBXA2R P21731 4/20 0.46
PTGER4 P35408 4/20 0.46
PTGFR P43088 3/20 0.46
PTGIR P43119 2/20 0.44
PTGER1 P34995 2/20 0.44
AKR1C3 P42330 3/20 0.41
AKR1C2 P52895 2/20 0.41
CA1 P00915 2/20 0.41
CA2 P00918 2/20 0.41
NFKB1 P19838 2/20 0.41
CA4 P22748 2/20 0.41
MIF P14174 1/20 0.40
LTB4R Q15722 1/20 0.40
LTB4R2 Q9NPC1 1/20 0.40
MAPT P10636 2/20 0.39
EIF2AK2 P19525 1/20 0.39

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
SCHEMBL3637308 1.00 EGFR (1.00) EGFRPTGER3PTGER2PTGDRTBXA2R
SCHEMBL14148738 0.81 EGFR (0.69) EGFRPTGER3PTGER2PTGDRTBXA2R
SCHEMBL15432136 0.81 EGFR (0.69) EGFRPTGER3PTGER2PTGDRTBXA2R
SCHEMBL17508764 0.81 EGFR (0.69) EGFRPTGER3PTGER2PTGDRTBXA2R
SCHEMBL27176782 0.81 EGFR (0.69) EGFRPTGER3PTGER2PTGDRTBXA2R
SCHEMBL17508763 0.81 EGFR (0.69) EGFRPTGER3PTGER2PTGDRTBXA2R
SCHEMBL5893730 0.78 EGFR (0.64) EGFRPTGER3PTGER2PTGDRTBXA2R
SCHEMBL6167022 0.78 EGFR (0.64) EGFRPTGER3PTGER2PTGDRTBXA2R
SCHEMBL6167026 0.78 EGFR (0.64) EGFRPTGER3PTGER2PTGDRTBXA2R
SCHEMBL4417309 0.78 EGFR (0.64) EGFRPTGER3PTGER2PTGDRTBXA2R

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9976172-B2 Method and apparatus for measuring protein post-translational modification ICAGEN, INC. (US) 2018-05-22 US claimed
US-20160201111-A1 Method and Apparatus for Measuring Protein Post-Translational Modification UNITED STATES GOVERNMENT 2016-07-14 US claimed
US-11561188-B2 Method and apparatus for measuring protein post-translational modification ICAGEN, LLC (US) 2023-01-24 US disclosed
US-20200157598-A1 METHOD AND APPARATUS FOR MEASURING PROTEIN POST-TRANSLATIONAL MODIFICATION ICAGEN, INC. 2020-05-21 US disclosed
US-10577642-B2 Method and apparatus for measuring protein post-translational modification ICAGEN, INC. (US) 2020-03-03 US disclosed
US-20180237823-A1 METHOD AND APPARATUS FOR MEASURING PROTEIN POST-TRANSLATIONAL MODIFICATION UNITED STATES GOVERNMENT 2018-08-23 US disclosed
US-9976172-B2 Method and apparatus for measuring protein post-translational modification ICAGEN, INC. (US) 2018-05-22 US disclosed
US-20160201111-A1 Method and Apparatus for Measuring Protein Post-Translational Modification UNITED STATES GOVERNMENT 2016-07-14 US disclosed
US-8778643-B2 Methods for increasing lipid levels and producing triacylglycerols in algae THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2014-07-15 US disclosed
US-8697350-B2 Biomarker combinations for colorectal cancer DIAGNOPLEX (CH) 2014-04-15 US disclosed
US-20130273620-A1 METHODS FOR ALTERING LIPIDS IN ALGAE AND YEAST THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2013-10-17 US disclosed
WO-2007056135-A1 METHOD OF TREATING CANCERS WITH SAHA AND PEMETREXED MERCK & CO., INC. (US) 2007-05-18 WO disclosed
WO-2007056162-A2 METHODS OF TREATING CANCERS WITH SAHA, CARBOPLATIN, AND PACLITAXEL AND OTHER COMBINATION THERAPIES MERCK & CO., INC. (US) 2007-05-18 WO disclosed
WO-2007056244-A2 METHODS OF USING SAHA AND ERLOTINIB FOR TREATING CANCER MERCK & CO., INC. (US) 2007-05-18 WO disclosed
WO-2007056232-A2 METHODS OF USING SAHA AND BORTEZOMIB FOR TREATING CANCER MERCK & CO., INC. (US) 2007-05-18 WO disclosed
WO-2006110608-A2 COMPOSITIONS AND METHOD FOR INCREASING THE EFFICACY OF EPIDERMAL GROWTH FACTOR RECEPTOR TYROSINE KINASE INHIBITORS TRUSTEES OF DARTMOUTH COLLEGE (US) 2006-10-19 WO disclosed
EP-0850055-B1 PROTEIN TYROSINE KINASE INHIBITORS FOR TREATING OSTEOARTHRITIS OSTEOARTHRITIS SCIENCES INC (US) 2005-06-29 EP disclosed
US-20050043264-A1 Methods of inhibiting neurodegenerative disease NATIONAL HEALTH RESEARCH INSTITUTES (TW) 2005-02-24 US disclosed
US-6552066-B1 Administering to the individual or animal a therapeutically effective amount of a protein tyrosine kinase inhibitor, with the proviso that protein tyrosine kinase inhibitor is not a flavone, isoflavone, hymenialdisine or its analog OSTEOARTHRITIS SCIENCES, INC. LIQUIDATING TRUST, RICHARD G. MCKENZIE, TRUSTEE, THE 2003-04-22 US disclosed
US-20030060515-A1 Protein tyrosine kinase inhibitors for treating osteoarthritis THE OSTEOARTHRITIS SCIENCES, INC. LIQUIDATING TRUST (US) 2003-03-27 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-20030060515-A1 Protein tyrosine kinase inhibitors for treating osteoarthritis MUSK, SRC, GRB2 EGFR 237/4885PTGER3 3513/4885PTGER2 3646/4885

“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.