SCHEMBL5569875

SCHEMBL5569875

Cc1[c]nc(NCCN2CCOCC2)nc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
JAK2 O60674 1/20 0.48
JAK1 P23458 1/20 0.48
TYK2 P29597 1/20 0.48
STAT3 P40763 1/20 0.48
JAK3 P52333 1/20 0.48
MKNK1 Q9BUB5 1/20 0.48
MEN1 O00255 2/20 0.47
KMT2A Q03164 2/20 0.47
CYP3A4 P08684 5/20 0.46
CYP2D6 P10635 3/20 0.46
CYP2C9 P11712 1/20 0.46
CYP1A2 P05177 4/20 0.46
LMNA P02545 2/20 0.46
HIF1A Q16665 2/20 0.46
HSD17B10 Q99714 2/20 0.46
TDP1 Q9NUW8 1/20 0.46
SMN1; SMN2 Q16637 2/20 0.44
EGFR P00533 1/20 0.44
CYP2C19 P33261 2/20 0.44
ALOX15 P16050 1/20 0.44

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
SCHEMBL14454206 0.77 MEN1 (0.52) JAK2JAK1TYK2STAT3JAK3
SCHEMBL1257037 0.77 KMT2A (0.51) JAK2JAK1TYK2STAT3JAK3
SCHEMBL1750786 0.76 MKNK1 (0.49) MKNK1MEN1KMT2ACYP3A4CYP2D6
SCHEMBL949738 0.75 MEN1 (0.52) MKNK1MEN1KMT2ACYP3A4CYP2D6
SCHEMBL2638129 0.74 KMT2A (0.49) MKNK1MEN1KMT2ACYP3A4CYP2D6
SCHEMBL8465810 0.73 MEN1 (0.57) MKNK1MEN1KMT2ACYP3A4CYP2D6
SCHEMBL21416877 0.72 LCK (0.58) JAK2JAK1TYK2STAT3JAK3
SCHEMBL15943680 0.70 IDO1 (0.49) MKNK1MEN1KMT2ACYP3A4CYP2D6
SCHEMBL7936724 0.70 CYP3A4 (0.52) MEN1KMT2ACYP3A4CYP2D6CYP2C9
SCHEMBL6833518 0.70 SRC (0.53) MEN1KMT2ACYP3A4CYP2D6CYP2C9

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-1753743-A1 PYRIDAZINONE DERIVATIVES, METHODS FOR PRODUCING THEM AND THEIR USE AS PHARMACEUTICALS Sanofi-Aventis Deutschland GmbH (DE) 2007-02-21 EP claimed
WO-2005111018-A1 PYRIDAZINONE DERIVATIVES, METHODS FOR PRODUCING THEM AND THEIR USE AS PHARMACEUTICALS SANOFI-AVENTIS DEUTSCHLAND GMBH (DE) 2005-11-24 WO claimed