SCHEMBL21991533

SCHEMBL21991533

COC(=O)CC(C)Oc1ccc(C(=O)Cc2ccc(Cl)cc2)cc1

nearest known ligand 0.52

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 3/20 0.52
NPC1 O15118 3/20 0.52
RAB9A P51151 2/20 0.52
MAPT P10636 2/20 0.48
KMT2A Q03164 3/20 0.46
KLK7 P49862 3/20 0.45
CNR2 P34972 1/20 0.44
ALDH1A1 P00352 2/20 0.44
MEN1 O00255 1/20 0.44
KDM4E B2RXH2 1/20 0.44
GAA P10253 1/20 0.44
EPHX2 P34913 1/20 0.42
LMNA P02545 1/20 0.41
HTT P42858 1/20 0.41
POLB P06746 1/20 0.41
FPR2 P25090 1/20 0.41

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
SCHEMBL21992669 0.89 L3MBTL1 (0.51) L3MBTL1NPC1RAB9AMAPTKMT2A
SCHEMBL21991592 0.88 L3MBTL1 (0.50) L3MBTL1NPC1RAB9AMAPTKMT2A
SCHEMBL21991952 0.88 L3MBTL1 (0.53) L3MBTL1NPC1RAB9AMAPTKMT2A
SCHEMBL21991313 0.87 L3MBTL1 (0.55) L3MBTL1NPC1RAB9AMAPTKMT2A
SCHEMBL21991912 0.87 L3MBTL1 (0.44) L3MBTL1NPC1RAB9AMAPTKMT2A
SCHEMBL21991519 0.87 GAA (0.50) RAB9AMAPTKMT2AALDH1A1MEN1
SCHEMBL21991312 0.85 HPGD (0.55) L3MBTL1RAB9AMAPTKMT2AALDH1A1
SCHEMBL21991318 0.84 L3MBTL1 (0.46) L3MBTL1NPC1RAB9AMAPTKMT2A
SCHEMBL21991906 0.83 GAA (0.47) L3MBTL1KMT2AALDH1A1GAA
SCHEMBL21991466 0.82 L3MBTL1 (0.55) L3MBTL1NPC1RAB9AMAPTKMT2A

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 L3MBTL1 1170/4885NPC1 233/4885RAB9A 1547/4885
US-20200138766-A1 CCL5 INHIBITORS CCL5, CCL11, CCR5 L3MBTL1 1170/4885NPC1 233/4885RAB9A 1547/4885
US-20210196665-A1 CCL5 Inhibitors CCL5, CCL11, CCR5 L3MBTL1 1170/4885NPC1 233/4885RAB9A 1547/4885
US-10940132-B2 CCL5 inhibitors CCL5, CCL11, CCR5 L3MBTL1 1170/4885NPC1 233/4885RAB9A 1547/4885
US-11318111-B2 CCL5 inhibitors CCL5, CCL11, CCR5 L3MBTL1 1170/4885NPC1 233/4885RAB9A 1547/4885
US-20220409566-A1 CCL5 Inhibitors CCL5, CCL11, CCR5 L3MBTL1 1170/4885NPC1 233/4885RAB9A 1547/4885

“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.