SCHEMBL3855941

SCHEMBL3855941

CS(=O)(=O)c1ccc(-c2cnc3ccc(-c4cn(C(c5ccccc5)(c5ccccc5)C5C=CC=CC5)nc4C(N)=O)cn23)s1

nearest known ligand 0.37

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
FLT3 P36888 9/20 0.37
MKNK1 Q9BUB5 1/20 0.32
MKNK2 Q9HBH9 1/20 0.32
TGFBR1 P36897 8/20 0.32
NEK2 P51955 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
SCHEMBL3844677 0.93 FLT3 (0.37) FLT3MKNK1MKNK2
SCHEMBL3850042 0.90 FLT3 (0.38) FLT3MKNK1MKNK2
SCHEMBL3866640 0.90 FLT3 (0.34) FLT3TGFBR1
SCHEMBL3847153 0.85 FLT3 (0.35) FLT3MKNK1MKNK2
SCHEMBL3855938 0.85 FLT3 (0.43) FLT3MKNK1MKNK2TGFBR1
SCHEMBL3846605 0.80 TGFBR1 (0.37) FLT3TGFBR1NEK2
SCHEMBL3847887 0.79 FLT3 (0.43) FLT3MKNK1MKNK2TGFBR1
SCHEMBL3853073 0.79 FLT3 (0.42) FLT3TGFBR1
SCHEMBL3850996 0.79 FLT3 (0.32) FLT3MKNK1MKNK2
SCHEMBL3865937 0.78 MKNK1 (0.35) 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