SCHEMBL21991772

SCHEMBL21991772

CCOC(=O)Oc1ccc(C(=O)c2ccc(Cl)cc2)cc1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ELANE P08246 7/20 0.58
HPGD P15428 1/20 0.57
SMN1; SMN2 Q16637 3/20 0.52
MAPT P10636 1/20 0.52
LMNA P02545 1/20 0.50
L3MBTL1 Q9Y468 1/20 0.50
PPARA Q07869 2/20 0.49
FABP2 P12104 1/20 0.49
PPARG P37231 1/20 0.49
SLC22A12 Q96S37 1/20 0.49
ABCB11 O95342 1/20 0.49
CYP1A2 P05177 1/20 0.49
CYP3A4 P08684 1/20 0.49
TSHR P16473 1/20 0.49
HTR2A P28223 1/20 0.49
PMP22 Q01453 1/20 0.49
MEN1 O00255 1/20 0.47
KMT2A Q03164 1/20 0.47
SRD5A2 P31213 1/20 0.46
MAPK1 P28482 1/20 0.46

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
SCHEMBL1808069 0.92 ABCB11 (0.56) ELANESMN1; SMN2MAPTLMNAPPARA
SCHEMBL21991771 0.87 MMP2 (0.53) HPGDSMN1; SMN2MAPTLMNAL3MBTL1
SCHEMBL10339728 0.84 ELANE (0.66) ELANEHPGDSMN1; SMN2MAPTLMNA
Urethane SCHEMBL21771921 0.84 CYP1A2 (0.49) HPGDSMN1; SMN2MAPTLMNAPPARA
SCHEMBL21991472 0.84 NPC1 (0.61) SMN1; SMN2MAPTLMNAL3MBTL1PPARA
SCHEMBL6451238 0.82 ALDH1A1 (0.55) SMN1; SMN2MAPTLMNAL3MBTL1TSHR
SCHEMBL21991481 0.81 HPGD (0.68) ELANEHPGDSMN1; SMN2MAPTLMNA
SCHEMBL929726 0.81 KMT2A (0.45) ELANESMN1; SMN2LMNAL3MBTL1CYP1A2
SCHEMBL21991753 0.80 MAOB (0.60) MAPTLMNAL3MBTL1
SCHEMBL3789020 0.80 HSD17B10 (0.53) SMN1; SMN2MAPTTSHRKMT2AMAPK1

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 ELANE 30/4885HPGD 765/4885SMN1; SMN2 3122/4885
US-20200138766-A1 CCL5 INHIBITORS CCL5, CCL11, CCR5 ELANE 30/4885HPGD 765/4885SMN1; SMN2 3122/4885
US-20210196665-A1 CCL5 Inhibitors CCL5, CCL11, CCR5 ELANE 30/4885HPGD 765/4885SMN1; SMN2 3122/4885
US-10940132-B2 CCL5 inhibitors CCL5, CCL11, CCR5 ELANE 30/4885HPGD 765/4885SMN1; SMN2 3122/4885
US-11318111-B2 CCL5 inhibitors CCL5, CCL11, CCR5 ELANE 30/4885HPGD 765/4885SMN1; SMN2 3122/4885
US-20220409566-A1 CCL5 Inhibitors CCL5, CCL11, CCR5 ELANE 30/4885HPGD 765/4885SMN1; SMN2 3122/4885

“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.