SCHEMBL23005205

SCHEMBL23005205

COc1nc(C(=O)N[C@@H](CCC(=O)O)C(=O)O)ccc1NC(=O)CCl

nearest known ligand 0.65

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
FPR2 P25090 9/20 0.65
P2RY12 Q9H244 1/20 0.41
IAPP P10997 1/20 0.41
CA2 P00918 3/20 0.40
CA1 P00915 2/20 0.40
GART P22102 1/20 0.40
CA12 O43570 1/20 0.38
CA9 Q16790 1/20 0.38
PYGL P06737 1/20 0.38
KDM4E B2RXH2 1/20 0.38
HPGD P15428 1/20 0.38

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
SCHEMBL23005206 1.00 FPR2 (0.65) FPR2P2RY12IAPPCA2CA1
SCHEMBL23005232 0.87 FPR2 (0.67) FPR2P2RY12CA2CA1PYGL
SCHEMBL23005235 0.87 FPR2 (0.67) FPR2P2RY12CA2CA1PYGL
SCHEMBL23005148 0.82 FPR2 (0.65) FPR2P2RY12KDM4EHPGD
SCHEMBL23005149 0.82 FPR2 (0.65) FPR2P2RY12KDM4EHPGD
SCHEMBL21515058 0.82 FPR2 (0.47) FPR2KDM4EHPGD
SCHEMBL30387675 0.82 FPR2 (0.47) FPR2KDM4EHPGD
SCHEMBL23005145 0.81 FPR2 (0.66) FPR2CA2CA1KDM4EHPGD
SCHEMBL23005146 0.81 FPR2 (0.66) FPR2CA2CA1KDM4EHPGD
SCHEMBL21494603 0.80 FPR2 (1.00) FPR2GART

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 435/4885P2RY12 1864/4885IAPP 295/4885

“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.