SCHEMBL25801860

SCHEMBL25801860

CCCCCCCCC(=O)NNC(=O)CC(C(=O)OC(C)(C)C)P(C)(=O)OCC

nearest known ligand 0.36

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.36
PLA2G4A P47712 4/20 0.35
KMT2A Q03164 3/20 0.35
MEN1 O00255 2/20 0.35
FAAH O00519 1/20 0.35
MAPK1 P28482 1/20 0.35
LPAR3 Q9UBY5 4/20 0.34
HSP90AA1 P07900 1/20 0.34
KDM4E B2RXH2 1/20 0.34
MAPT P10636 1/20 0.34
P2RX7 Q99572 1/20 0.33
LPAR6 P43657 1/20 0.33
LPAR1 Q92633 1/20 0.33
LPAR4 Q99677 1/20 0.33
LPAR5 Q9H1C0 1/20 0.33
LPAR2 Q9HBW0 1/20 0.33
ALDH1A1 P00352 1/20 0.33

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
SCHEMBL25801923 0.85 GAA (0.36) GAAPLA2G4AFAAHLPAR3LPAR6
SCHEMBL25801535 0.76 TSHR (0.31) GAAALDH1A1
SCHEMBL25801865 0.74 NOS1 (0.30)
SCHEMBL25801531 0.74 TSHR (0.31)
SCHEMBL25802002 0.73 MMP8 (0.33)
SCHEMBL25801863 0.72 TSHR (0.32)
SCHEMBL10535135 0.71 APLNR (0.53) GAAKMT2AMEN1FAAHMAPK1
SCHEMBL27732646 0.69 APLNR (0.54) GAAKMT2AMEN1FAAHMAPK1
SCHEMBL28842631 0.69 HSP90AA1 (0.31) LPAR3HSP90AA1LPAR6LPAR1LPAR4
SCHEMBL31529071 0.67 FAAH (0.57) KMT2AMEN1FAAHMAPK1HSP90AA1

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-20230219907-A1 CARBOXY DERIVATIVES WITH ANTIINFLAMATORY PROPERTIES SITRYX THERAPEUTICS LIMITED (GB) 2023-07-13 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-20230219907-A1 CARBOXY DERIVATIVES WITH ANTIINFLAMATORY PROPERTIES CPA2, RO60, C5AR1 GAA 1592/4885PLA2G4A 1037/4885KMT2A 3125/4885

“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.