SCHEMBL21991982

SCHEMBL21991982

CCOC(=O)C(C)(C)CCOc1ccc(OCc2ccc(C(F)(F)F)cc2)cc1

nearest known ligand 0.56

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MAOB P27338 8/20 0.56
FFAR1 O14842 3/20 0.52
PPARG P37231 1/20 0.52
PPARA Q07869 1/20 0.47
HRH3 Q9Y5N1 1/20 0.46
PTGDR2 Q9Y5Y4 2/20 0.45
SLC6A5 Q9Y345 1/20 0.45
NR4A2 P43354 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
SCHEMBL21991924 0.93 PPARA (0.53) MAOBFFAR1PPARGPPARA
SCHEMBL21992736 0.89 PPARA (0.50) MAOBPPARA
SCHEMBL21991970 0.88 MAOB (0.59) MAOBFFAR1PPARGHRH3PTGDR2
SCHEMBL21991358 0.88 MAOB (0.59) MAOBFFAR1PPARGPPARAHRH3
SCHEMBL21992733 0.85 MAOB (0.52) MAOBFFAR1PPARAHRH3NR4A2
SCHEMBL21991585 0.85 PPARA (0.64) MAOBFFAR1PPARGPPARAHRH3
SCHEMBL21991603 0.85 MAOB (0.55) MAOBFFAR1PPARGPPARAHRH3
SCHEMBL21991824 0.83 MAOB (0.59) MAOBFFAR1PPARGPPARA
SCHEMBL21991530 0.81 MAOB (0.60) MAOBFFAR1PPARGHRH3PTGDR2
SCHEMBL21991304 0.79 NPC1 (0.51) MAOBFFAR1PPARGPPARA

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 MAOB 3946/4885FFAR1 147/4885PPARG 1583/4885
US-20200138766-A1 CCL5 INHIBITORS CCL5, CCL11, CCR5 MAOB 3946/4885FFAR1 147/4885PPARG 1583/4885
US-20210196665-A1 CCL5 Inhibitors CCL5, CCL11, CCR5 MAOB 3946/4885FFAR1 147/4885PPARG 1583/4885
US-10940132-B2 CCL5 inhibitors CCL5, CCL11, CCR5 MAOB 3946/4885FFAR1 147/4885PPARG 1583/4885
US-11318111-B2 CCL5 inhibitors CCL5, CCL11, CCR5 MAOB 3946/4885FFAR1 147/4885PPARG 1583/4885
US-20220409566-A1 CCL5 Inhibitors CCL5, CCL11, CCR5 MAOB 3946/4885FFAR1 147/4885PPARG 1583/4885

“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.