SCHEMBL6890650

SCHEMBL6890650

CCCCCc1ccccc1C(O)C(=O)O

nearest known ligand 0.59

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CYSLTR2 Q9NS75 10/20 0.59
CYSLTR1 Q9Y271 10/20 0.59
BID P55957 3/20 0.48
MCL1 Q07820 3/20 0.48
BCL2L1 Q07817 2/20 0.48
BAK1 Q16611 2/20 0.48
KAT8 Q9H7Z6 2/20 0.48
PPARG P37231 1/20 0.48
PPARA Q07869 1/20 0.48
EP300 Q09472 1/20 0.48
KAT2A Q92830 1/20 0.48
KAT2B Q92831 1/20 0.48
KAT5 Q92993 1/20 0.48
SAE1 Q9UBE0 1/20 0.48
LIPG Q9Y5X9 1/20 0.47

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
SCHEMBL7916115 0.98 CYSLTR2 (0.62) CYSLTR2CYSLTR1BIDMCL1BCL2L1
SCHEMBL4029728 0.88 CYSLTR2 (0.46) CYSLTR2CYSLTR1PPARGPPARA
SCHEMBL11011751 0.86 BID (0.51) CYSLTR2CYSLTR1BIDMCL1BCL2L1
SCHEMBL9667336 0.86 CYSLTR2 (0.56) CYSLTR2CYSLTR1BIDMCL1BCL2L1
SCHEMBL9068158 0.85 BID (0.54) CYSLTR2CYSLTR1BIDMCL1BCL2L1
SCHEMBL28373053 0.84 CYSLTR2 (0.59) CYSLTR2CYSLTR1BIDMCL1BCL2L1
SCHEMBL11011747 0.84 CYSLTR2 (0.46) CYSLTR2CYSLTR1
SCHEMBL5570575 0.83 LMNA (0.48) CYSLTR2CYSLTR1
SCHEMBL3266290 0.83 LMNA (0.48) CYSLTR2CYSLTR1
SCHEMBL10435204 0.83 CYSLTR2 (0.62) CYSLTR2CYSLTR1BIDMCL1BCL2L1

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
CN-106692144-A Compositions and methods for prophylaxis and treatment of addictions 奥默罗斯公司 2017-05-24 CN disclosed
US-20040044075-A1 Alpha acyloxyacetamides for kallikrein and urokinase inhibition GENZYME CORPORATION 2004-03-04 US disclosed
WO-2003101941-A2 ALPHA ACYLOXYACETAMIDES FOR KALLIKREIN AND UROKINASE INHIBITION GENZYME CORPORATION (US) 2003-12-11 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-20040044075-A1 Alpha acyloxyacetamides for kallikrein and urokinase inhibition KLK1, KLK2, KLKB1 CYSLTR2 207/4885CYSLTR1 314/4885BID 4060/4885

“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.