SCHEMBL21991328

SCHEMBL21991328

CC(COc1ccc(F)cc1)C(C)C(=O)O

nearest known ligand 0.45

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
NR4A2 P43354 1/20 0.44
MAOB P27338 2/20 0.43
MME P08473 1/20 0.43
ACE P12821 1/20 0.43
CPA1 P15085 1/20 0.43
ACE2 Q9BYF1 1/20 0.43
PPARG P37231 1/20 0.42
PPARA Q07869 1/20 0.42
FFAR1 O14842 1/20 0.42
ADAMTS4 O75173 1/20 0.41
LMNA P02545 1/20 0.41
ALDH1A1 P00352 1/20 0.41

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
SCHEMBL21991932 0.85 LDHA (0.50) KDM4ESMN1; SMN2PPARGPPARAFFAR1
SCHEMBL21991567 0.84 TSHR (0.43) MAOBALDH1A1
SCHEMBL21992712 0.83 KDM4E (0.54) KDM4ESMN1; SMN2MAOBFFAR1LMNA
SCHEMBL21991335 0.83 PPARA (0.55) NR4A2MAOBPPARGPPARAALDH1A1
SCHEMBL21991887 0.83 MAPT (0.48) KDM4EMAOBLMNA
SCHEMBL21991929 0.83 MAPT (0.40) KDM4ESMN1; SMN2NR4A2MAOBLMNA
SCHEMBL21991983 0.83 MAOB (0.47) MAOBMMEACECPA1ACE2
SCHEMBL7178491 0.80 FFAR1 (0.48) KDM4ESMN1; SMN2NR4A2FFAR1LMNA
SCHEMBL21992007 0.80 PPARA (0.51) NR4A2PPARGPPARAALDH1A1
SCHEMBL21991962 0.79 MEN1 (0.46) MAOBMMEACECPA1ACE2

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 KDM4E 4518/4885SMN1; SMN2 3122/4885NR4A2 1549/4885
US-20200138766-A1 CCL5 INHIBITORS CCL5, CCL11, CCR5 KDM4E 4518/4885SMN1; SMN2 3122/4885NR4A2 1549/4885
US-20210196665-A1 CCL5 Inhibitors CCL5, CCL11, CCR5 KDM4E 4518/4885SMN1; SMN2 3122/4885NR4A2 1549/4885
US-10940132-B2 CCL5 inhibitors CCL5, CCL11, CCR5 KDM4E 4518/4885SMN1; SMN2 3122/4885NR4A2 1549/4885
US-11318111-B2 CCL5 inhibitors CCL5, CCL11, CCR5 KDM4E 4518/4885SMN1; SMN2 3122/4885NR4A2 1549/4885
US-20220409566-A1 CCL5 Inhibitors CCL5, CCL11, CCR5 KDM4E 4518/4885SMN1; SMN2 3122/4885NR4A2 1549/4885

“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.