SCHEMBL29676576

SCHEMBL29676576

c1ccc(-c2ccc(C3CCCN(c4ccccn4)C3)cc2)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.46
MAPK1 P28482 1/20 0.46
SLC6A7 Q99884 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
GBA1 P04062 1/20 0.45
AVPR1A P37288 1/20 0.43
MAP4K4 O95819 1/20 0.42
PROKR1 Q8TCW9 3/20 0.42
GSK3B P49841 1/20 0.42
ROCK2 O75116 1/20 0.42
ROCK1 Q13464 1/20 0.42
CDC42BPB Q9Y5S2 1/20 0.42
MAPT P10636 2/20 0.41
HTT P42858 2/20 0.41
BCHE P06276 1/20 0.41
ACHE P22303 1/20 0.41
BACE1 P56817 1/20 0.41
MEN1 O00255 1/20 0.41
LMNA P02545 1/20 0.41
KMT2A Q03164 1/20 0.41

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
SCHEMBL22795445 1.00 ALDH1A1 (0.46) ALDH1A1MAPK1SLC6A7L3MBTL1GBA1
SCHEMBL22795084 1.00 ALDH1A1 (0.46) ALDH1A1MAPK1SLC6A7L3MBTL1GBA1
SCHEMBL22795449 1.00 ALDH1A1 (0.46) ALDH1A1MAPK1SLC6A7L3MBTL1GBA1
SCHEMBL21341955 0.83 AVPR1A (0.54) ALDH1A1MAPK1L3MBTL1AVPR1APROKR1
SCHEMBL22795079 0.78 SLC6A7 (0.49) ALDH1A1SLC6A7L3MBTL1GBA1GSK3B
SCHEMBL22795435 0.78 SLC6A7 (0.49) ALDH1A1SLC6A7L3MBTL1GBA1GSK3B
SCHEMBL22795442 0.78 SLC6A7 (0.49) ALDH1A1SLC6A7L3MBTL1GBA1GSK3B
SCHEMBL31368522 0.78 KAT2B (0.46) ALDH1A1L3MBTL1AVPR1APROKR1GSK3B
SCHEMBL22795549 0.75 GBA1 (0.43) GBA1PROKR1GSK3BROCK2ROCK1
SCHEMBL22795028 0.75 GBA1 (0.43) GBA1PROKR1GSK3BROCK2ROCK1

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12115154-B2 Compounds for the modulation of proprotein convertase subtilisin/kexin type 9 (PCSK9) SRX CARDIO, LLC (US) 2024-10-15 US disclosed
US-20220267269-A1 COMPOUNDS FOR THE MODULATION OF PROPROTEIN CONVERTASE SUBTILISIN/KEXIN TYPE 9 (PCSK9) SRX CARDIO LLC (US) 2022-08-25 US disclosed
US-20220193058-A1 COMPOUNDS FOR THE MODULATION OF PROPROTEIN CONVERTASE SUBTILISIN/KEXIN TYPE 9 (PCSK9) SRX CARDIO, LLC 2022-06-23 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 (3 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-20220193058-A1 COMPOUNDS FOR THE MODULATION OF PROPROTEIN CONVERTASE SUBTILISIN/KEXIN TYPE 9 (PCSK9) PCSK9, PCSK6, PCSK7 ALDH1A1 4740/4885MAPK1 2562/4885SLC6A7 4716/4885
US-12115154-B2 Compounds for the modulation of proprotein convertase subtilisin/kexin type 9 (PCSK9) PCSK9, PCSK6, PCSK7 ALDH1A1 4740/4885MAPK1 2562/4885SLC6A7 4716/4885
US-20220267269-A1 COMPOUNDS FOR THE MODULATION OF PROPROTEIN CONVERTASE SUBTILISIN/KEXIN TYPE 9 (PCSK9) PCSK9, PCSK6, PCSK7 ALDH1A1 4740/4885MAPK1 2562/4885SLC6A7 4716/4885

“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.