SCHEMBL23005141

SCHEMBL23005141

O=CN(c1ncc(NC(=O)CCl)cc1C(F)(F)F)[C@@H](CCC(=O)O)C(=O)O

nearest known ligand 0.40

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
FPR2 P25090 3/20 0.40
GSTO1 P78417 2/20 0.35
HIF1A Q16665 5/20 0.35
FOLH1 Q04609 1/20 0.33
LMNA P02545 1/20 0.33
MTHFD1 P11586 1/20 0.32
MTHFD2 P13995 1/20 0.32
MAP2K7 O14733 2/20 0.32
MAPT P10636 2/20 0.31
KDM4E B2RXH2 1/20 0.31
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31
TRPM8 Q7Z2W7 1/20 0.31
GSK3B P49841 1/20 0.31
USP2 O75604 1/20 0.30
NPSR1 Q6W5P4 1/20 0.30
ALDH1A1 P00352 1/20 0.30
GALK1 P51570 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
SCHEMBL23005174 0.87 FPR2 (0.38) FPR2HIF1AFOLH1MTHFD1MTHFD2
SCHEMBL23005169 0.86 FPR2 (0.39) FPR2GSTO1HIF1AFOLH1LMNA
SCHEMBL23005244 0.85 FPR2 (0.38) FPR2HIF1AFOLH1LMNAMTHFD1
SCHEMBL21494666 0.81 FPR2 (0.66) FPR2MTHFD1MTHFD2
SCHEMBL23005112 0.81 EPOR (0.33) FPR2TRPM8
SCHEMBL23005260 0.77 ALDH1A1 (0.50) LMNAMAPTMEN1KMT2ATRPM8
SCHEMBL23005142 0.73 FPR2 (0.65) FPR2FOLH1MTHFD1MTHFD2KDM4E
SCHEMBL23005143 0.73 FPR2 (0.65) FPR2FOLH1MTHFD1MTHFD2KDM4E
SCHEMBL23005242 0.72 RORC (0.38) FPR2MTHFD1MTHFD2
SCHEMBL23005116 0.69 FPR2 (0.31) FPR2TRPM8

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3781554-B1 2,6-DIAMINO-3,4-DIHYDROPYRIMIDIN-4-ONE DERIVATIVES AND USE THEREOF IN THERAPY THOMAS HELLEDAYS STIFTELSE FOER MEDICINSK FORSKNING (SE) 2023-06-28 EP disclosed
US-20210052587-A1 2,6-DIAMINO-3,4-DIHYDROPYRIMIDIN-4-ONE DERIVATIVES AND USE THEREOF IN THERAPY MEDICINSK FORSKNING (SE) 2021-02-25 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-20210052587-A1 2,6-DIAMINO-3,4-DIHYDROPYRIMIDIN-4-ONE DERIVATIVES AND USE THEREOF IN THERAPY IL2, THPO, IL6 FPR2 435/4885GSTO1 2048/4885HIF1A 1261/4885

“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.