SCHEMBL21992003

SCHEMBL21992003

CCOC(=O)CC(C)C(C)Oc1ccc(C(=O)c2ccc(Cl)cc2)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 2/20 0.47
SMN1; SMN2 Q16637 3/20 0.44
PPARA Q07869 3/20 0.42
ABCB11 O95342 2/20 0.42
CYP1A2 P05177 2/20 0.42
CYP3A4 P08684 2/20 0.42
TSHR P16473 2/20 0.42
HTR2A P28223 2/20 0.42
PPARG P37231 2/20 0.42
PMP22 Q01453 2/20 0.42
MAPT P10636 2/20 0.42
NPSR1 Q6W5P4 2/20 0.42
MEN1 O00255 1/20 0.42
USP2 O75604 1/20 0.42
LMNA P02545 1/20 0.42
ADORA3 P0DMS8 1/20 0.42
CYP2C9 P11712 1/20 0.42
ADRB3 P13945 1/20 0.42
CNR1 P21554 1/20 0.42
ACHE P22303 1/20 0.42

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
SCHEMBL21991338 0.93 PPARA (0.46) HPGDSMN1; SMN2PPARAABCB11CYP1A2
SCHEMBL21991960 0.90 PPARA (0.43) SMN1; SMN2PPARAABCB11CYP1A2CYP3A4
SCHEMBL21992008 0.87 L3MBTL1 (0.51) SMN1; SMN2PPARAPPARGMAPTCYP2C9
SCHEMBL21991352 0.87 HPGD (0.53) HPGDSMN1; SMN2PPARAABCB11CYP1A2
SCHEMBL21991903 0.87 HPGD (0.49) HPGDSMN1; SMN2PPARAABCB11CYP1A2
SCHEMBL21991344 0.86 KMT2A (0.52) HPGDSMN1; SMN2PPARAABCB11CYP1A2
SCHEMBL21992011 0.84 FFAR1 (0.52) HPGDMAPTLMNAABCG2EPHX2
SCHEMBL21992719 0.84 HPGD (0.51) HPGDSMN1; SMN2PPARAABCB11CYP1A2
SCHEMBL21992608 0.83 HPGD (0.50) HPGDSMN1; SMN2PPARAABCB11CYP1A2
SCHEMBL21992715 0.81 ALOX15 (0.45) HPGDMAPTMEN1KMT2ARAB9A

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 HPGD 765/4885SMN1; SMN2 3122/4885PPARA 806/4885
US-20200138766-A1 CCL5 INHIBITORS CCL5, CCL11, CCR5 HPGD 765/4885SMN1; SMN2 3122/4885PPARA 806/4885
US-20210196665-A1 CCL5 Inhibitors CCL5, CCL11, CCR5 HPGD 765/4885SMN1; SMN2 3122/4885PPARA 806/4885
US-10940132-B2 CCL5 inhibitors CCL5, CCL11, CCR5 HPGD 765/4885SMN1; SMN2 3122/4885PPARA 806/4885
US-11318111-B2 CCL5 inhibitors CCL5, CCL11, CCR5 HPGD 765/4885SMN1; SMN2 3122/4885PPARA 806/4885
US-20220409566-A1 CCL5 Inhibitors CCL5, CCL11, CCR5 HPGD 765/4885SMN1; SMN2 3122/4885PPARA 806/4885

“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.