SCHEMBL5824397

SCHEMBL5824397

CCCC(O)CCN(CC)CC

nearest known ligand 0.34

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PLA2G1B P04054 1/20 0.34
PLA2G2A P14555 1/20 0.34
SIGMAR1 Q99720 1/20 0.32
FDPS P14324 1/20 0.32
LMNA P02545 1/20 0.30
L3MBTL1 Q9Y468 1/20 0.30

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
SCHEMBL9851901 0.85 DRD3 (0.33) FDPSLMNA
SCHEMBL6370391 0.83 THRB (0.42) SIGMAR1
SCHEMBL7229021 0.82 SIGMAR1 (0.33) PLA2G1BPLA2G2ASIGMAR1L3MBTL1
SCHEMBL3490986 0.80 THRB (0.43) PLA2G1BPLA2G2ASIGMAR1LMNAL3MBTL1
SCHEMBL24450556 0.80 THRB (0.43) PLA2G1BPLA2G2ASIGMAR1LMNAL3MBTL1
Hydrochloric Acid SCHEMBL29274396 0.78 THRB (0.42) SIGMAR1LMNAL3MBTL1
Hydrochloric Acid SCHEMBL29274395 0.78 THRB (0.42) SIGMAR1LMNAL3MBTL1
SCHEMBL22249 0.78
SCHEMBL1147030 0.77 SIGMAR1 (0.42) PLA2G1BPLA2G2ASIGMAR1LMNAL3MBTL1
SCHEMBL1961042 0.77 L3MBTL1 (0.46) PLA2G1BPLA2G2ALMNAL3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7135466-B2 Quinoline and quinazoline derivatives and drugs containing the same KIRIN BEER KABUSHIKI KAISHA (JP) 2006-11-14 US disclosed
US-20060211717-A1 Quinoline and quinazoline derivatives and drugs containing the same KIRIN BEER KABUSHIKI KAISHA (JP) 2006-09-21 US disclosed
US-20040132727-A1 Quinoline and quinazoline derivatives and drugs containing the same KIRIN HOLDINGS KABUSHIKI KAISHA (JP) 2004-07-08 US disclosed
EP-1243582-A1 QUINOLINE AND QUINAZOLINE DERIVATIVES AND DRUGS CONTAINING THE SAME KIRIN BEER KABUSHIKI KAISHA (JP) 2002-09-25 EP disclosed
US-5106878-A Synergistic effects with other fungicides HOFFMANN-LA ROCHE INC. (US) 1992-04-21 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 (2 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-20060211717-A1 Quinoline and quinazoline derivatives and drugs containing the same PDGFRA, PDGFRB, PDGFA PLA2G1B 4107/4885PLA2G2A 3441/4885SIGMAR1 77/4885
US-20040132727-A1 Quinoline and quinazoline derivatives and drugs containing the same PDGFRA, PDGFRB, PDGFA PLA2G1B 4419/4885PLA2G2A 3881/4885SIGMAR1 104/4885

“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.