SCHEMBL21991256

SCHEMBL21991256

COC(=O)Oc1ccc(OCc2ccc(Cl)cc2)cc1

nearest known ligand 0.63

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MAOB P27338 8/20 0.63
MAOA P21397 3/20 0.63
NR4A2 P43354 1/20 0.60
NPC1 O15118 1/20 0.60
RAB9A P51151 1/20 0.60
APP P05067 1/20 0.54
FFAR1 O14842 1/20 0.53
PKM P14618 1/20 0.50

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
SCHEMBL21369977 0.87 NPC1 (0.64) MAOBNPC1RAB9AAPPFFAR1
SCHEMBL21991812 0.87 MAOB (0.58) MAOBMAOANR4A2NPC1RAB9A
SCHEMBL21991753 0.85 MAOB (0.60) MAOBMAOANR4A2NPC1RAB9A
SCHEMBL1598439 0.85 KMT2A (0.53)
SCHEMBL21992513 0.82 NR4A2 (0.71) MAOBMAOANR4A2NPC1RAB9A
SCHEMBL23605967 0.81 PTGS2 (0.68) MAOBMAOANR4A2NPC1RAB9A
SCHEMBL6295262 0.81 NPC1 (0.70) MAOBMAOANR4A2NPC1RAB9A
SCHEMBL11218725 0.81 NPC1 (0.86) MAOBMAOANR4A2NPC1RAB9A
SCHEMBL21991493 0.81 MAOB (0.66) MAOBFFAR1
SCHEMBL10597979 0.80 KMT2A (0.66) MAOBMAOANR4A2NPC1RAB9A

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 MAOB 3946/4885MAOA 3996/4885NR4A2 1549/4885
US-20200138766-A1 CCL5 INHIBITORS CCL5, CCL11, CCR5 MAOB 3946/4885MAOA 3996/4885NR4A2 1549/4885
US-20210196665-A1 CCL5 Inhibitors CCL5, CCL11, CCR5 MAOB 3946/4885MAOA 3996/4885NR4A2 1549/4885
US-10940132-B2 CCL5 inhibitors CCL5, CCL11, CCR5 MAOB 3946/4885MAOA 3996/4885NR4A2 1549/4885
US-11318111-B2 CCL5 inhibitors CCL5, CCL11, CCR5 MAOB 3946/4885MAOA 3996/4885NR4A2 1549/4885
US-20220409566-A1 CCL5 Inhibitors CCL5, CCL11, CCR5 MAOB 3946/4885MAOA 3996/4885NR4A2 1549/4885

“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.