SCHEMBL3846419

SCHEMBL3846419

O=C(c1ccc(-c2nn(C(c3ccccc3)(c3ccccc3)C3C=CC=CC3)cc2-c2ccc3ncc(-c4ccccn4)n3c2)cc1)N1CCOCC1

nearest known ligand 0.46

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
MKNK1 Q9BUB5 19/20 0.46
MKNK2 Q9HBH9 19/20 0.46
EIF4E P06730 4/20 0.44
IRAK4 Q9NWZ3 1/20 0.42

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
SCHEMBL3847229 0.90 TGFBR1 (0.37) MKNK1MKNK2EIF4EIRAK4
SCHEMBL3846417 0.86 MKNK1 (0.53) MKNK1MKNK2EIF4EIRAK4
SCHEMBL3847482 0.85 TGFBR1 (0.34) IRAK4
SCHEMBL3847290 0.85 TGFBR1 (0.35) IRAK4
SCHEMBL3850696 0.83 TGFBR1 (0.35) IRAK4
SCHEMBL3850101 0.81 TGFBR1 (0.33) IRAK4
SCHEMBL3845555 0.79 TGFBR1 (0.33) MKNK1MKNK2
SCHEMBL3845247 0.79 FLT3 (0.31)
SCHEMBL3848181 0.78 FLT3 (0.39)
SCHEMBL3848375 0.78 FYN (0.38) MKNK1MKNK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2048142-A2 Nitrogen-containing condensed cyclic compound having a pyrazolyl group as a substituent group and pharmaceutical composition thereof Eisai R&D Management Co., Ltd. (JP) 2009-04-15 EP disclosed
EP-1382603-B1 NITROGENOUS FUSED-RING COMPOUND HAVING PYRAZOLYL GROUP AS SUBSTITUENT AND MEDICINAL COMPOSITION THEREOF EISAI R&D MAN CO LTD (JP) 2008-07-23 EP disclosed
US-7074801-B1 Nitrogen-containing condensed cyclic compound having a pyrazolyl group as a substituent group and pharmaceutical composition thereof EISAI CO., LTD. (JP) 2006-07-11 US disclosed
EP-1382603-A1 NITROGENOUS FUSED−RING COMPOUND HAVING PYRAZOLYL GROUP AS SUBSTITUENT AND MEDICINAL COMPOSITION THEREOF Eisai Co., Ltd. (JP) 2004-01-21 EP disclosed