SCHEMBL30564477

SCHEMBL30564477

C=CCOC(=O)N1CC=C(Br)CC1

nearest known ligand 0.40

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.40
MAPK1 P28482 1/20 0.40
RAB9A P51151 1/20 0.40
ERN1 O75460 10/20 0.39
SLC6A15 Q9H2J7 1/20 0.37
CYP3A4 P08684 1/20 0.35
GPR119 Q8TDV5 1/20 0.34
F10 P00742 2/20 0.33
PLG P00747 2/20 0.33
F2 P00734 1/20 0.33
GRM5 P41594 1/20 0.33
PRSS1 P07477 1/20 0.33
PRSS2 P07478 1/20 0.33
PRSS3 P35030 1/20 0.33
CHRM1 P11229 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32
PTP4A3 O75365 1/20 0.32
PTP4A1 Q93096 1/20 0.32

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
SCHEMBL7958636 0.81 ERN1 (0.43) LMNAMAPK1RAB9AERN1SLC6A15
SCHEMBL9382711 0.80 LMNA (0.39) LMNAMAPK1RAB9AERN1SLC6A15
SCHEMBL7956038 0.78 LMNA (0.37) LMNAMAPK1RAB9AERN1SLC6A15
SCHEMBL597800 0.74 LMNA (0.45) LMNAMAPK1RAB9AERN1SLC6A15
SCHEMBL10548337 0.74 LMNA (0.40) LMNAMAPK1RAB9AERN1SLC6A15
SCHEMBL5196825 0.73 LMNA (0.41) LMNAMAPK1RAB9AERN1SLC6A15
SCHEMBL9191402 0.72 LMNA (0.42) LMNAMAPK1RAB9AERN1SLC6A15
SCHEMBL8924794 0.72 LMNA (0.42) LMNAMAPK1RAB9AERN1SLC6A15
SCHEMBL9383271 0.72 ERN1 (0.49) LMNAMAPK1RAB9AERN1SLC6A15
SCHEMBL7962633 0.72 LMNA (0.35) LMNAMAPK1RAB9AERN1SLC6A15

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230257343-A1 NOVEL AMINO ACID DERIVATIVES PEPTIDREAM INC (JP) 2023-08-17 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 (1 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-20230257343-A1 NOVEL AMINO ACID DERIVATIVES DNPEP, BCAT1, ANPEP LMNA 3240/4885MAPK1 2316/4885RAB9A 1747/4885

“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.