SCHEMBL4607938

SCHEMBL4607938

O=Cc1cc(Cl)ccc1/C=C/C(=O)O

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ERN1 O75460 2/20 0.52
▸ TDP1 Q9NUW8 1/20 0.50
▸ MAPT P10636 4/20 0.49
▸ ITGB2 P05107 2/20 0.49
▸ ICAM1 P05362 2/20 0.49
▸ ITGAL P20701 2/20 0.49
▸ PTGER3 P43115 2/20 0.49
▸ PTGER2 P43116 2/20 0.49
▸ TBXA2R P21731 1/20 0.49
▸ PTGFR P43088 1/20 0.49
▸ PTGIR P43119 1/20 0.49
▸ PTGDR Q13258 1/20 0.49
▸ PLA2G1B P04054 1/20 0.49
▸ ATG4B Q9Y4P1 1/20 0.49
▸ LMNA P02545 2/20 0.46
▸ ALDH1A1 P00352 2/20 0.45
▸ KDM4E B2RXH2 1/20 0.45
▸ GAA P10253 1/20 0.45
▸ L3MBTL1 Q9Y468 1/20 0.45
▸ MIF P14174 1/20 0.45

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
SCHEMBL4607942 1.00 ERN1 (0.52) ERN1TDP1MAPTITGB2ICAM1
SCHEMBL8123759 0.82 ITGB2 (0.49) TDP1MAPTITGB2ICAM1ITGAL
SCHEMBL8123761 0.82 ITGB2 (0.49) TDP1MAPTITGB2ICAM1ITGAL
SCHEMBL29406682 0.81 PTGER3 (0.55) MAPTITGB2ICAM1ITGALPTGER3
SCHEMBL29419102 0.81 MAPT (0.65) TDP1MAPTITGB2ICAM1ITGAL
SCHEMBL481451 0.81 MAPT (0.65) TDP1MAPTITGB2ICAM1ITGAL
SCHEMBL165227 0.81 MAPT (0.65) TDP1MAPTITGB2ICAM1ITGAL
SCHEMBL7378645 0.81 PTGER3 (0.55) MAPTITGB2ICAM1ITGALPTGER3
SCHEMBL7378640 0.81 PTGER3 (0.55) MAPTITGB2ICAM1ITGALPTGER3
SCHEMBL30898270 0.80 MAPT (0.49) ERN1TDP1MAPTLMNAALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080255150-A1 Novel Compounds ASTRAZENECA AB (SE) 2008-10-16 — — US disclosed
EP-1948630-A2 NOVEL COMPOUNDS AstraZeneca AB (SE) 2008-07-30 — — EP disclosed
WO-2007052023-A2 NOVEL COMPOUNDS ASTRAZENECA AB (SE) 2007-05-10 — — 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 (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-20080255150-A1 Novel Compounds CFTR, H4C1; H4C2; H4C3; H4C4; H4C5; H4C6; H4C8; H4C9; H4C11; H4C12; H4C13; H4C14; H4C15; H4C16, CYP11B2 ERN1 3865/4885TDP1 4457/4885MAPT 3534/4885

“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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