SCHEMBL18251504

SCHEMBL18251504

COCCN(C)CCCS(=O)(=O)O

nearest known ligand 0.41

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ LTA4H P09960 2/20 0.41
▸ PIK3CD O00329 1/20 0.39
▸ APP P05067 1/20 0.35
▸ SMYD3 Q9H7B4 1/20 0.35
▸ MEN1 O00255 1/20 0.31
▸ KMT2A Q03164 1/20 0.31
▸ S1PR2 O95136 1/20 0.31
▸ S1PR1 P21453 1/20 0.31
▸ S1PR3 Q99500 1/20 0.31
▸ S1PR5 Q9H228 1/20 0.31
▸ FDPS P14324 1/20 0.31
▸ MAPK1 P28482 1/20 0.30
▸ TLR8 Q9NR97 1/20 0.30
▸ TLR7 Q9NYK1 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
SCHEMBL18251503 0.88 LTA4H (0.43) LTA4HPIK3CDMEN1KMT2A
SCHEMBL17832919 0.83 LTA4H (0.40) LTA4HAPP
SCHEMBL14505541 0.83 LTA4H (0.47) LTA4HPIK3CDAPPMEN1KMT2A
SCHEMBL24277491 0.82 APP (0.37) LTA4HAPPMAPK1
SCHEMBL16790489 0.80 LTA4H (0.39) LTA4HAPPS1PR2S1PR1S1PR3
SCHEMBL18251201 0.80 LTA4H (0.39) LTA4HAPP
SCHEMBL16063010 0.78 APP (0.39) LTA4HAPP
SCHEMBL5335869 0.78 KDM4C (0.40) LTA4HAPPS1PR2S1PR1S1PR3
SCHEMBL25199783 0.78 APP (0.39) LTA4HAPP
SCHEMBL5263631 0.78 S1PR2 (0.41) LTA4HAPPS1PR2S1PR1S1PR3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3468996-B1 ANTI-EGFR ANTIBODY DRUG CONJUGATES ABBVIE INC (US) 2022-05-04 — — EP 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
WO-2017214282-A1 ANTI-EGFR 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

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 LTA4H 1195/4885PIK3CD 3103/4885APP 3623/4885
US-20160339117-A1 BCL-XL Inhibitory Compounds Having Low Cell Permeability and Antibody Drug Conjugates Including the Same BCL2, BAX, BCL9 LTA4H 4414/4885PIK3CD 1460/4885APP 3533/4885

“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.

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