SCHEMBL2161790

SCHEMBL2161790

COC(=O)CC(O)Cc1ccc(-c2ccccc2)cc1

nearest known ligand 0.53

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ SRR Q9GZT4 2/20 0.53
▸ PSAT1 Q9Y617 2/20 0.53
▸ PPARG P37231 9/20 0.51
▸ PPARA Q07869 7/20 0.51
▸ PPARD Q03181 1/20 0.50
▸ ABCB1 P08183 1/20 0.49
▸ MMP12 P39900 2/20 0.49
▸ MMP2 P08253 1/20 0.49
▸ MMP9 P14780 1/20 0.49
▸ MMP13 P45452 1/20 0.49
▸ MMP14 P50281 1/20 0.49
▸ MME P08473 1/20 0.47
▸ ACE P12821 1/20 0.47
▸ CPA1 P15085 1/20 0.47
▸ ACE2 Q9BYF1 1/20 0.47
▸ TRPA1 O75762 1/20 0.46
▸ HDAC1 Q13547 2/20 0.46
▸ HDAC6 Q9UBN7 2/20 0.46

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
SCHEMBL7633821 0.90 ABCB1 (0.57) SRRPPARGPPARAABCB1CPA1
SCHEMBL11837761 0.83 SRR (0.48) SRRPSAT1PPARGPPARAPPARD
SCHEMBL22677522 0.82 SRR (0.53) SRRPSAT1PPARGPPARAPPARD
SCHEMBL6800633 0.82 MMP12 (0.70) SRRPSAT1PPARGPPARAMMP12
SCHEMBL379630 0.82 MMP12 (0.70) SRRPSAT1PPARGPPARAMMP12
SCHEMBL8902344 0.81 LDHA (0.57) PPARGPPARA
SCHEMBL6808125 0.79 SRR (0.57) SRRPSAT1PPARGPPARAMMP12
SCHEMBL11828803 0.79 SRR (0.43) SRRPSAT1PPARGPPARAPPARD
SCHEMBL22076559 0.78 PTGS2 (0.47) MMP12
SCHEMBL1428025 0.76 LMNA (0.62) —

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
US-8987312-B2 Alpha-keto heterocycles as FAAH inhibitors THE SCRIPPS RESEARCH INSTITUTE (US) 2015-03-24 — — US disclosed
US-8987312-B2 Alpha-keto heterocycles as FAAH inhibitors THE SCRIPPS RESEARCH INSTITUTE (US) 2015-03-24 — — US disclosed
US-8987312-B2 Alpha-keto heterocycles as FAAH inhibitors THE SCRIPPS RESEARCH INSTITUTE (US) 2015-03-24 — — US disclosed
US-20110183947-A1 ALPHA-KETO HETEROCYCLES AS FAAH INHIBITORS THE SCRIPPS RESEARCH INSTITUTE (US) 2011-07-28 — — US disclosed
US-20110183947-A1 ALPHA-KETO HETEROCYCLES AS FAAH INHIBITORS THE SCRIPPS RESEARCH INSTITUTE (US) 2011-07-28 — — US disclosed
US-20110183947-A1 ALPHA-KETO HETEROCYCLES AS FAAH INHIBITORS THE SCRIPPS RESEARCH INSTITUTE (US) 2011-07-28 — — US disclosed
WO-2010005572-A2 ALPHA-KETO HETEROCYCLES AS FAAH INHIBITORS THE SCRIPPS RESEARCH INSTITUTE (US) 2010-01-14 — — WO disclosed
WO-2010005572-A2 ALPHA-KETO HETEROCYCLES AS FAAH INHIBITORS THE SCRIPPS RESEARCH INSTITUTE (US) 2010-01-14 — — 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-20110183947-A1 ALPHA-KETO HETEROCYCLES AS FAAH INHIBITORS FAAH, FAAH2, FADS1 SRR 1241/4885PSAT1 2478/4885PPARG 687/4885

“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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