SCHEMBL21991887

SCHEMBL21991887

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

nearest known ligand 0.48

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.48
KMT2A Q03164 4/20 0.42
MEN1 O00255 3/20 0.42
TDP1 Q9NUW8 2/20 0.42
KDM4E B2RXH2 1/20 0.42
GAA P10253 1/20 0.42
LMNA P02545 2/20 0.42
MAOB P27338 2/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
CYP1A2 P05177 1/20 0.41
CYP2C9 P11712 1/20 0.41
CYP2C19 P33261 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
HRH2 P25021 1/20 0.40
HRH1 P35367 1/20 0.40
NPC1 O15118 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
SCHEMBL21991567 0.86 TSHR (0.43) MAPTKMT2AMEN1GAAMAOB
SCHEMBL21991341 0.86 TSHR (0.45) MAPTKMT2AMEN1TDP1KDM4E
SCHEMBL21991342 0.85 CYP1A2 (0.49) MAPTKMT2AMEN1TDP1GAA
SCHEMBL21991561 0.85 KDM4E (0.45) MAPTKMT2AMEN1TDP1KDM4E
SCHEMBL21991929 0.85 MAPT (0.40) MAPTKDM4ELMNAMAOBNPSR1
SCHEMBL21991930 0.84 PPARD (0.49) MAOBNPC1
SCHEMBL21991328 0.83 KDM4E (0.44) KDM4ELMNAMAOB
SCHEMBL11760381 0.82 LTA4H (0.51) MAPTTDP1LMNAL3MBTL1NPC1
SCHEMBL21992727 0.81 CYP1A2 (0.46) MAPTKMT2AMEN1TDP1GAA
SCHEMBL21991601 0.81 PPARD (0.47) KMT2AMEN1MAOBNPC1

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 MAPT 4264/4885KMT2A 4842/4885MEN1 3749/4885
US-20200138766-A1 CCL5 INHIBITORS CCL5, CCL11, CCR5 MAPT 4264/4885KMT2A 4842/4885MEN1 3749/4885
US-20210196665-A1 CCL5 Inhibitors CCL5, CCL11, CCR5 MAPT 4264/4885KMT2A 4842/4885MEN1 3749/4885
US-10940132-B2 CCL5 inhibitors CCL5, CCL11, CCR5 MAPT 4264/4885KMT2A 4842/4885MEN1 3749/4885
US-11318111-B2 CCL5 inhibitors CCL5, CCL11, CCR5 MAPT 4264/4885KMT2A 4842/4885MEN1 3749/4885
US-20220409566-A1 CCL5 Inhibitors CCL5, CCL11, CCR5 MAPT 4264/4885KMT2A 4842/4885MEN1 3749/4885

“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.