SCHEMBL7654697

SCHEMBL7654697

CN(C(=O)c1cnc(C(=O)N(C)C(O)CCO)cn1)C(O)CCO

nearest known ligand 0.31

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31
CYP2C19 P33261 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
SCHEMBL7655707 0.85 P4HTM (0.37) MEN1KMT2ACYP2C19
SCHEMBL7663607 0.83
SCHEMBL7655191 0.82 CNR2 (0.30)
SCHEMBL7663615 0.80 SIRT6 (0.30)
SCHEMBL7661229 0.80 CYP1A2 (0.38)
SCHEMBL7651976 0.77 KMT2A (0.37) MEN1KMT2ACYP2C19
SCHEMBL7103531 0.77 MEN1 (0.33) MEN1KMT2A
SCHEMBL7104707 0.75 PNP (0.36) MEN1KMT2A
SCHEMBL7108522 0.71 SMO (0.40) MEN1KMT2A
SCHEMBL7106490 0.69 MEN1 (0.36) MEN1KMT2A

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
US-6399613-B1 N,N'-BIS(2-HYDROXYETHYL)PYRAZINE-2,5- OR -2,6-DICARBOXAMIDE; DIABETES AVENTIS PHARMA S.A. (FR) 2002-06-04 US claimed
US-6399613-B1 N,N'-BIS(2-HYDROXYETHYL)PYRAZINE-2,5- OR -2,6-DICARBOXAMIDE; DIABETES AVENTIS PHARMA S.A. (FR) 2002-06-04 US disclosed