SCHEMBL21991849

SCHEMBL21991849

CCOC(=O)CCOc1ccc(Br)cc1

nearest known ligand 0.58

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.58
LTA4H P09960 3/20 0.51
L3MBTL1 Q9Y468 2/20 0.50
HRH2 P25021 1/20 0.50
HRH1 P35367 1/20 0.50
TSHR P16473 1/20 0.48
POLB P06746 1/20 0.48
KMT2A Q03164 2/20 0.48
ALDH1A1 P00352 1/20 0.48
HPGD P15428 1/20 0.48
MAOB P27338 1/20 0.48
MEN1 O00255 1/20 0.47
S1PR4 O95977 1/20 0.47
LMNA P02545 1/20 0.47
S1PR1 P21453 1/20 0.47
MAPK1 P28482 1/20 0.47
NPSR1 Q6W5P4 1/20 0.47

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
SCHEMBL1623579 0.92 BRD4 (0.54) MAPTLTA4HHRH2HRH1
SCHEMBL1285034 0.90 LTA4H (0.53) MAPTLTA4HHRH2HRH1ALDH1A1
SCHEMBL1285180 0.89 LTA4H (0.52) MAPTLTA4HHRH2HRH1
SCHEMBL1284955 0.89 LTA4H (0.52) MAPTLTA4HHRH2HRH1
SCHEMBL1286274 0.88 HRH2 (0.58) MAPTLTA4HHRH2HRH1
SCHEMBL3951838 0.86 L3MBTL1 (0.66) LTA4HL3MBTL1TSHRPOLBKMT2A
SCHEMBL21992555 0.85 MAPT (0.60) MAPTLTA4HPOLBALDH1A1HPGD
SCHEMBL7692039 0.85 LTA4H (0.52) MAPTLTA4HL3MBTL1TSHRPOLB
SCHEMBL7692040 0.85 LTA4H (0.52) LTA4HL3MBTL1TSHRPOLBKMT2A
SCHEMBL28532238 0.84 NPSR1 (0.51) MAPTHRH2HRH1KMT2AMAOB

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 4264/4885LTA4H 99/4885L3MBTL1 1170/4885
US-20200138766-A1 CCL5 INHIBITORS CCL5, CCL11, CCR5 MAPT 4264/4885LTA4H 99/4885L3MBTL1 1170/4885
US-20210196665-A1 CCL5 Inhibitors CCL5, CCL11, CCR5 MAPT 4264/4885LTA4H 99/4885L3MBTL1 1170/4885
US-10940132-B2 CCL5 inhibitors CCL5, CCL11, CCR5 MAPT 4264/4885LTA4H 99/4885L3MBTL1 1170/4885
US-11318111-B2 CCL5 inhibitors CCL5, CCL11, CCR5 MAPT 4264/4885LTA4H 99/4885L3MBTL1 1170/4885
US-20220409566-A1 CCL5 Inhibitors CCL5, CCL11, CCR5 MAPT 4264/4885LTA4H 99/4885L3MBTL1 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.