SCHEMBL21992473

SCHEMBL21992473

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

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 2/20 0.54
RAB9A P51151 2/20 0.54
L3MBTL1 Q9Y468 2/20 0.54
MAPT P10636 3/20 0.49
EPHX2 P34913 4/20 0.48
KMT2A Q03164 2/20 0.45
POLB P06746 1/20 0.44
KLK7 P49862 1/20 0.43
PPARG P37231 3/20 0.42
PPARA Q07869 3/20 0.42
CYP1A2 P05177 2/20 0.42
CYP2C9 P11712 2/20 0.42
CYP2C19 P33261 2/20 0.42
MEN1 O00255 1/20 0.42
USP2 O75604 1/20 0.42
ABCB11 O95342 1/20 0.42
LMNA P02545 1/20 0.42
CYP3A4 P08684 1/20 0.42
ADORA3 P0DMS8 1/20 0.42
ADRB3 P13945 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
SCHEMBL21991466 0.88 L3MBTL1 (0.55) NPC1RAB9AL3MBTL1MAPTEPHX2
SCHEMBL21991842 0.88 L3MBTL1 (0.51) NPC1RAB9AL3MBTL1MAPTEPHX2
SCHEMBL21991473 0.87 EPHX2 (0.63) NPC1RAB9AL3MBTL1MAPTEPHX2
SCHEMBL21991367 0.85 EPHX2 (0.60) NPC1RAB9AL3MBTL1MAPTEPHX2
SCHEMBL21991795 0.85 EPHX2 (0.60) NPC1RAB9AL3MBTL1MAPTEPHX2
SCHEMBL21992735 0.85 EPHX2 (0.60) NPC1RAB9AL3MBTL1MAPTEPHX2
SCHEMBL11462507 0.85 EPHX2 (0.50) MAPTEPHX2KMT2APOLBPPARG
SCHEMBL21103699 0.85 CYP1A2 (0.53) L3MBTL1MAPTEPHX2KMT2APOLB
SCHEMBL21991450 0.85 CYP1A2 (0.53) L3MBTL1MAPTEPHX2KMT2APOLB
SCHEMBL21991768 0.84 KMT2A (0.58) MAPTEPHX2KMT2APOLBPPARG

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.