SCHEMBL17833157

SCHEMBL17833157

CCCNCC(O)C(O)CO

nearest known ligand 0.43

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ANPEP P15144 1/20 0.41
KDM4E B2RXH2 3/20 0.38
LMNA P02545 4/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
TDP1 Q9NUW8 2/20 0.32
ABCB1 P08183 2/20 0.32
CNR1 P21554 1/20 0.31
ADRA1A P35348 1/20 0.31
PAOX Q6QHF9 1/20 0.30
ABCC3 O15438 1/20 0.30
SMN1; SMN2 Q16637 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
SCHEMBL3685829 0.86 KDM4E (0.56) ANPEPKDM4ELMNAL3MBTL1TDP1
SCHEMBL3371743 0.86 KDM4E (0.56) ANPEPKDM4ELMNAL3MBTL1TDP1
SCHEMBL3800695 0.86 KDM4E (0.56) ANPEPKDM4ELMNAL3MBTL1TDP1
SCHEMBL3371251 0.86 KDM4E (0.56) ANPEPKDM4ELMNAL3MBTL1TDP1
SCHEMBL17833039 0.86 KDM4E (0.50) ANPEPKDM4ELMNAL3MBTL1TDP1
SCHEMBL17833168 0.85 KDM4E (0.54) ANPEPKDM4ELMNAL3MBTL1TDP1
Hydrochloric Acid SCHEMBL11410943 0.85 TSHR (0.41) ANPEPKDM4ELMNAABCC3SMN1; SMN2
SCHEMBL8839893 0.80 LMNA (0.36) KDM4ELMNAL3MBTL1TDP1SMN1; SMN2
SCHEMBL17833165 0.79 LMNA (0.37) ANPEPKDM4ELMNAL3MBTL1TDP1
SCHEMBL8529667 0.79 LMNA (0.44) KDM4ELMNAL3MBTL1TDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4104865-A1 ANTI-EGFR ANTIBODY DRUG CONJUGATES AbbVie Inc. (US) 2022-12-21 EP disclosed
EP-3468996-B1 ANTI-EGFR ANTIBODY DRUG CONJUGATES ABBVIE INC (US) 2022-05-04 EP disclosed
WO-2017214282-A1 ANTI-EGFR ANTIBODY DRUG CONJUGATES ABBVIE INC. (US) 2017-12-14 WO disclosed
US-20170355769-A1 ANTI-B7-H3 ANTIBODIES AND ANTIBODY DRUG CONJUGATES ABBVIE INC. 2017-12-14 US disclosed
WO-2017214335-A1 ANTI-B7-H3 ANTIBODIES AND ANTIBODY DRUG CONJUGATES ABBVIE INC. (US) 2017-12-14 WO disclosed
WO-2017214462-A2 ANTI-CD98 ANTIBODIES AND ANTIBODY DRUG CONJUGATES ABBVIE INC. (US) 2017-12-14 WO disclosed
US-20160339117-A1 BCL-XL Inhibitory Compounds Having Low Cell Permeability and Antibody Drug Conjugates Including the Same ABBVIE INC. (US) 2016-11-24 US disclosed
WO-2016094509-A1 BCL XL INHIBITORY COMPOUNDS HAVING LOW CELL PERMEABILITY AND ANTIBODY DRUG CONJUGATES INCLUDING THE SAME ABBVIE INC. (US) 2016-06-16 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 (2 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-20170355769-A1 ANTI-B7-H3 ANTIBODIES AND ANTIBODY DRUG CONJUGATES HRH3, H1-3, CD274 ANPEP 1011/4885KDM4E 424/4885LMNA 4613/4885
US-20160339117-A1 BCL-XL Inhibitory Compounds Having Low Cell Permeability and Antibody Drug Conjugates Including the Same BCL2, BAX, BCL9 ANPEP 2729/4885KDM4E 1299/4885LMNA 1814/4885

“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.