SCHEMBL21991607

SCHEMBL21991607

CC(C)(CCOc1ccc(OCc2ccc(Cl)cc2)cc1)C(=O)O

nearest known ligand 0.62

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 7/20 0.62
NR4A2 P43354 2/20 0.58
MAOB P27338 4/20 0.57
MAOA P21397 2/20 0.57
PPARD Q03181 2/20 0.50
PPARG P37231 2/20 0.50
FFAR1 O14842 1/20 0.49
NPC1 O15118 1/20 0.49
RAB9A P51151 1/20 0.49
HRH3 Q9Y5N1 1/20 0.49
APP P05067 1/20 0.49

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
SCHEMBL21992682 0.91 PPARA (0.72) PPARAPPARDPPARG
SCHEMBL21991362 0.87 PPARA (0.67) PPARAPPARDPPARG
SCHEMBL21991363 0.86 MAOB (0.55) PPARANR4A2MAOBMAOANPC1
SCHEMBL21991969 0.86 NR4A2 (0.61) PPARANR4A2MAOBMAOAPPARG
SCHEMBL21991356 0.84 PPARA (0.68) PPARANR4A2PPARDPPARGNPC1
SCHEMBL21992733 0.84 MAOB (0.52) PPARANR4A2MAOBMAOAFFAR1
SCHEMBL21991590 0.84 PPARA (0.57) PPARANR4A2MAOBMAOAPPARD
SCHEMBL28710418 0.84 PPARA (0.84) PPARAPPARDPPARG
SCHEMBL21991585 0.84 PPARA (0.64) PPARANR4A2MAOBPPARDPPARG
SCHEMBL11035881 0.83 PPARA (0.74) PPARANR4A2PPARDPPARG

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
US-20220409566-A1 CCL5 Inhibitors LAPKO INC, dba AFECTA PHARMACEUTICALS 2022-12-29 US disclosed
US-20220142961-A1 CCL5 Inhibitors LAPKO INC, dba AFECTA PHARMACEUTICALS 2022-05-12 US disclosed
US-11318111-B2 CCL5 inhibitors LAPKO INC (US) 2022-05-03 US disclosed
US-20210196665-A1 CCL5 Inhibitors AFECTA PHARMACEUTICALS, INC. (US) 2021-07-01 US disclosed
US-10940132-B2 CCL5 inhibitors AFECTA PHARMACEUTICALS, INC. (US) 2021-03-09 US disclosed
US-20200138766-A1 CCL5 INHIBITORS LAPKO INC. DBA AFECTA PHARMACEUTICALS 2020-05-07 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 (6 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-20220142961-A1 CCL5 Inhibitors CCL5, CCL11, CCR5 PPARA 806/4885NR4A2 1549/4885MAOB 3946/4885
US-20200138766-A1 CCL5 INHIBITORS CCL5, CCL11, CCR5 PPARA 806/4885NR4A2 1549/4885MAOB 3946/4885
US-20210196665-A1 CCL5 Inhibitors CCL5, CCL11, CCR5 PPARA 806/4885NR4A2 1549/4885MAOB 3946/4885
US-10940132-B2 CCL5 inhibitors CCL5, CCL11, CCR5 PPARA 806/4885NR4A2 1549/4885MAOB 3946/4885
US-11318111-B2 CCL5 inhibitors CCL5, CCL11, CCR5 PPARA 806/4885NR4A2 1549/4885MAOB 3946/4885
US-20220409566-A1 CCL5 Inhibitors CCL5, CCL11, CCR5 PPARA 806/4885NR4A2 1549/4885MAOB 3946/4885

“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.