SCHEMBL21992673

SCHEMBL21992673

COC(=O)C(C)(C)COc1ccc(C(=O)Cc2ccc(Cl)cc2)cc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 5/20 0.52
RAB9A P51151 4/20 0.52
L3MBTL1 Q9Y468 3/20 0.52
MAPT P10636 4/20 0.48
MAOA P21397 1/20 0.46
MAOB P27338 1/20 0.46
KDM4E B2RXH2 2/20 0.45
LMNA P02545 2/20 0.45
SSTR4 P31391 1/20 0.44
NR4A2 P43354 1/20 0.44
MEN1 O00255 3/20 0.44
KMT2A Q03164 3/20 0.44
ALDH1A1 P00352 2/20 0.44
GAA P10253 1/20 0.44
CNR2 P34972 1/20 0.41
HTT P42858 1/20 0.41
DGAT1 O75907 1/20 0.41
ELANE P08246 1/20 0.41
KCNH2 Q12809 1/20 0.41
SMN1; SMN2 Q16637 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
SCHEMBL21991536 0.88 L3MBTL1 (0.53) NPC1RAB9AL3MBTL1MAPTMAOA
SCHEMBL21992725 0.88 NPC1 (0.50) NPC1RAB9AL3MBTL1MAPTMAOA
SCHEMBL21992667 0.87 L3MBTL1 (0.55) NPC1RAB9AL3MBTL1MAPTMAOA
SCHEMBL21991560 0.87 MAPT (0.50) NPC1RAB9AL3MBTL1MAPTMAOA
SCHEMBL21748570 0.87 SSTR4 (0.53) NPC1RAB9AL3MBTL1MAPTMAOA
SCHEMBL21992666 0.85 ELANE (0.56) NPC1RAB9AL3MBTL1MAPTMAOA
SCHEMBL21992687 0.84 MAOB (0.57) NPC1RAB9AMAOAMAOBSSTR4
SCHEMBL21992664 0.83 SSTR4 (0.50) L3MBTL1MAPTSSTR4MEN1KMT2A
SCHEMBL21991244 0.82 NPC1 (0.55) NPC1RAB9AL3MBTL1MAPTLMNA
SCHEMBL24805907 0.79 PTGS2 (0.62) NPC1RAB9AL3MBTL1MAPTMAOA

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

“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.