SCHEMBL21992668

SCHEMBL21992668

COC(=O)CC(C)Oc1ccc(Oc2ccc(C(F)(F)F)cc2)cc1

nearest known ligand 0.45

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
FNTA P49354 1/20 0.44
FNTB P49356 1/20 0.44
MAPK14 Q16539 1/20 0.43
PPARG P37231 2/20 0.43
PPARA Q07869 2/20 0.43
MMP2 P08253 3/20 0.42
MMP9 P14780 3/20 0.42
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
LTA4H P09960 1/20 0.41
EPHX2 P34913 1/20 0.41
LMNA P02545 2/20 0.40
MTNR1A P48039 1/20 0.40
MTNR1B P49286 1/20 0.40
ALDH1A1 P00352 1/20 0.40
FPR2 P25090 1/20 0.40
SCN9A Q15858 1/20 0.40

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
SCHEMBL21992648 0.96 PPARG (0.46) PPARGPPARAMEN1KMT2ALMNA
SCHEMBL21991999 0.88 FNTA (0.43) FNTAFNTBMAPK14PPARGPPARA
SCHEMBL21991900 0.88 PPARG (0.42) FNTAFNTBMAPK14PPARGPPARA
SCHEMBL21991320 0.86 NPC1 (0.41) FNTAFNTBPPARGPPARA
SCHEMBL21991562 0.86 MAOB (0.57) PPARGMMP2MMP9
SCHEMBL21991923 0.86 FNTA (0.51) FNTAFNTBMAPK14PPARGPPARA
SCHEMBL21992659 0.85 FNTA (0.38) FNTAFNTBMAPK14PPARGPPARA
SCHEMBL11003578 0.85 MMP2 (0.42) FNTAFNTBMAPK14PPARGPPARA
SCHEMBL11080757 0.83 PPARG (0.43) FNTAFNTBMAPK14PPARGPPARA
SCHEMBL21991294 0.83 PPARG (0.45) PPARGPPARAALDH1A1

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 FNTA 1687/4885FNTB 2493/4885MAPK14 2558/4885
US-20200138766-A1 CCL5 INHIBITORS CCL5, CCL11, CCR5 FNTA 1687/4885FNTB 2493/4885MAPK14 2558/4885
US-20210196665-A1 CCL5 Inhibitors CCL5, CCL11, CCR5 FNTA 1687/4885FNTB 2493/4885MAPK14 2558/4885
US-10940132-B2 CCL5 inhibitors CCL5, CCL11, CCR5 FNTA 1687/4885FNTB 2493/4885MAPK14 2558/4885
US-11318111-B2 CCL5 inhibitors CCL5, CCL11, CCR5 FNTA 1687/4885FNTB 2493/4885MAPK14 2558/4885
US-20220409566-A1 CCL5 Inhibitors CCL5, CCL11, CCR5 FNTA 1687/4885FNTB 2493/4885MAPK14 2558/4885

“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.