SCHEMBL21991748

SCHEMBL21991748

CCCCC(Oc1ccc(F)cc1)C(=O)OC

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PPARG P37231 3/20 0.44
PPARA Q07869 2/20 0.44
FAAH O00519 3/20 0.44
ALDH1A1 P00352 2/20 0.43
CA1 P00915 1/20 0.42
CA2 P00918 1/20 0.42
PTGES O14684 1/20 0.42
ALOX5 P09917 1/20 0.42
TAS1R3 Q7RTX0 1/20 0.41
TAS1R1 Q7RTX1 1/20 0.41
TP53 P04637 1/20 0.41
MAPT P10636 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
HTR7 P34969 1/20 0.41
LMNA P02545 1/20 0.40
CYP2D6 P10635 1/20 0.39
KCNH2 Q12809 1/20 0.39
HPGD P15428 2/20 0.39
HDAC3 O15379 1/20 0.39
HDAC1 Q13547 1/20 0.39

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
SCHEMBL21991234 0.88 ALDH2 (0.48) PPARGPPARAFAAHALDH1A1PTGES
SCHEMBL21991757 0.88 TAS1R3 (0.52) PPARGPPARACA1CA2TAS1R3
SCHEMBL21991743 0.86 PPARG (0.43) PPARGPPARAFAAHALDH1A1PTGES
SCHEMBL21991747 0.85 PPARA (0.52) PPARGPPARACA1CA2CYP2D6
SCHEMBL21991787 0.85 MGLL (0.46) PPARGPPARAALDH1A1CA1CA2
SCHEMBL21103822 0.85 PPARA (0.52) PPARGPPARACA1CA2CYP2D6
SCHEMBL1565681 0.85 PPARA (0.57) PPARGPPARAFAAHPTGESALOX5
SCHEMBL11858517 0.85 PPARG (0.50) PPARGPPARAALDH1A1CA1CA2
SCHEMBL21991229 0.85 PPARG (0.48) PPARGPPARAALDH1A1CA1CA2
SCHEMBL5162436 0.84 RAB9A (0.51) ALDH1A1CA1CA2MAPTSMN1; SMN2

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 5 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-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 (5 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-20200138766-A1 CCL5 INHIBITORS CCL5, CCL11, CCR5 PPARG 1583/4885PPARA 806/4885FAAH 1704/4885
US-20210196665-A1 CCL5 Inhibitors CCL5, CCL11, CCR5 PPARG 1583/4885PPARA 806/4885FAAH 1704/4885
US-10940132-B2 CCL5 inhibitors CCL5, CCL11, CCR5 PPARG 1583/4885PPARA 806/4885FAAH 1704/4885
US-11318111-B2 CCL5 inhibitors CCL5, CCL11, CCR5 PPARG 1583/4885PPARA 806/4885FAAH 1704/4885
US-20220409566-A1 CCL5 Inhibitors CCL5, CCL11, CCR5 PPARG 1583/4885PPARA 806/4885FAAH 1704/4885

“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.