SCHEMBL21991845

SCHEMBL21991845

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

nearest known ligand 0.63

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MAOB P27338 7/20 0.63
FFAR1 O14842 3/20 0.51
SLC6A5 Q9Y345 2/20 0.51
PPARG P37231 1/20 0.51
HRH3 Q9Y5N1 1/20 0.50
SMPD1 P17405 1/20 0.50
MEN1 O00255 1/20 0.49
KMT2A Q03164 1/20 0.49
PPARA Q07869 1/20 0.49
MRGPRX4 Q96LA9 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
SCHEMBL21991262 0.92 ALDH1A1 (0.53) MAOBPPARGMEN1KMT2APPARA
SCHEMBL18002977 0.89 MAOB (0.63) MAOBFFAR1SLC6A5PPARGPPARA
SCHEMBL21992617 0.87 LTA4H (0.49) MAOBPPARGMEN1KMT2APPARA
SCHEMBL21991530 0.87 MAOB (0.60) MAOBFFAR1SLC6A5PPARGHRH3
SCHEMBL23605765 0.86 MAOB (0.66) MAOBFFAR1SLC6A5PPARGHRH3
SCHEMBL13280077 0.86 MAOB (0.66) MAOBFFAR1SLC6A5PPARGHRH3
SCHEMBL21991287 0.86 MAOB (0.59) MAOBFFAR1SLC6A5PPARGHRH3
SCHEMBL21991284 0.85 MAOB (0.63) MAOBFFAR1PPARGHRH3PPARA
SCHEMBL21992633 0.82 MAOB (0.60) MAOBKMT2A
SCHEMBL21991493 0.81 MAOB (0.66) MAOBFFAR1SLC6A5PPARGHRH3

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 147/4885SLC6A5 837/4885
US-20200138766-A1 CCL5 INHIBITORS CCL5, CCL11, CCR5 MAOB 3946/4885FFAR1 147/4885SLC6A5 837/4885
US-20210196665-A1 CCL5 Inhibitors CCL5, CCL11, CCR5 MAOB 3946/4885FFAR1 147/4885SLC6A5 837/4885
US-10940132-B2 CCL5 inhibitors CCL5, CCL11, CCR5 MAOB 3946/4885FFAR1 147/4885SLC6A5 837/4885
US-11318111-B2 CCL5 inhibitors CCL5, CCL11, CCR5 MAOB 3946/4885FFAR1 147/4885SLC6A5 837/4885
US-20220409566-A1 CCL5 Inhibitors CCL5, CCL11, CCR5 MAOB 3946/4885FFAR1 147/4885SLC6A5 837/4885

“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.