SCHEMBL21992541

SCHEMBL21992541

CC(C)(CC(=O)O)Oc1ccc(F)cc1

nearest known ligand 0.41

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 8/20 0.41
PPARG P37231 4/20 0.41
GAA P10253 1/20 0.41
PPARD Q03181 2/20 0.40
CYP2C19 P33261 2/20 0.40
SMN1; SMN2 Q16637 2/20 0.40
KDM4E B2RXH2 1/20 0.40
MEN1 O00255 1/20 0.40
CYP1A2 P05177 1/20 0.40
CYP3A4 P08684 1/20 0.40
CYP2D6 P10635 1/20 0.40
MAPT P10636 1/20 0.40
KMT2A Q03164 1/20 0.40
HPGD P15428 1/20 0.39
NR4A2 P43354 1/20 0.39
HIF1A Q16665 1/20 0.39
LTA4H P09960 1/20 0.38
MAOB P27338 1/20 0.38

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
SCHEMBL21991809 0.84 CA1 (0.47) PPARAPPARGKDM4EMAPT
SCHEMBL23605988 0.84 L3MBTL1 (0.49) PPARAPPARGGAAPPARDCYP2C19
SCHEMBL21992551 0.83 PPARA (0.47) PPARAPPARGPPARDSMN1; SMN2MAOB
SCHEMBL21991498 0.83 KMT2A (0.41) PPARAGAASMN1; SMN2KDM4ECYP1A2
SCHEMBL21992534 0.82 PPARA (0.61) PPARAPPARGPPARDCYP2C19SMN1; SMN2
SCHEMBL21991270 0.82 PPARA (0.43) PPARAPPARGPPARDCYP2C19SMN1; SMN2
SCHEMBL21991259 0.80 POLB (0.47) PPARAPPARGGAACYP2C19KDM4E
SCHEMBL21991525 0.79 MEN1 (0.46) PPARAPPARGPPARDSMN1; SMN2MEN1
SCHEMBL21991245 0.79 MAPT (0.47) PPARAPPARGGAACYP2C19SMN1; SMN2
SCHEMBL14447040 0.79 MRGPRX4 (0.45) SMN1; SMN2KMT2A

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 PPARA 806/4885PPARG 1583/4885GAA 2392/4885
US-20200138766-A1 CCL5 INHIBITORS CCL5, CCL11, CCR5 PPARA 806/4885PPARG 1583/4885GAA 2392/4885
US-20210196665-A1 CCL5 Inhibitors CCL5, CCL11, CCR5 PPARA 806/4885PPARG 1583/4885GAA 2392/4885
US-10940132-B2 CCL5 inhibitors CCL5, CCL11, CCR5 PPARA 806/4885PPARG 1583/4885GAA 2392/4885
US-11318111-B2 CCL5 inhibitors CCL5, CCL11, CCR5 PPARA 806/4885PPARG 1583/4885GAA 2392/4885
US-20220409566-A1 CCL5 Inhibitors CCL5, CCL11, CCR5 PPARA 806/4885PPARG 1583/4885GAA 2392/4885

“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.