SCHEMBL25745940

SCHEMBL25745940

N/N=C(/CCCNC(=O)c1ccc(NC(=O)Cc2c(N)nc(N)[nH]c2=O)cn1)NN

nearest known ligand 0.58

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ FPR2 P25090 18/20 0.58
▸ MTHFD1 P11586 1/20 0.45
▸ MTHFD2 P13995 1/20 0.45
▸ AKR1B1 P15121 1/20 0.41

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
SCHEMBL25745892 0.78 NAMPT (0.41) —
SCHEMBL21494625 0.78 FPR2 (0.71) FPR2MTHFD1MTHFD2
SCHEMBL21494617 0.75 FPR2 (0.67) FPR2MTHFD1MTHFD2
SCHEMBL21494679 0.73 FPR2 (1.00) FPR2MTHFD1MTHFD2
SCHEMBL31657846 0.73 FPR2 (1.00) FPR2MTHFD1MTHFD2
SCHEMBL21494675 0.73 FPR2 (1.00) FPR2MTHFD1MTHFD2
SCHEMBL25745634 0.73 FPR2 (0.72) FPR2MTHFD1MTHFD2AKR1B1
SCHEMBL21494623 0.73 FPR2 (1.00) FPR2MTHFD1MTHFD2AKR1B1
SCHEMBL21494624 0.73 FPR2 (1.00) FPR2MTHFD1MTHFD2AKR1B1
SCHEMBL30106777 0.73 FPR2 (1.00) FPR2MTHFD1MTHFD2AKR1B1

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
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
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