SCHEMBL3846103

SCHEMBL3846103

CS(=O)(=O)c1ccc(-c2cnc3ccc(-c4cnn(C(c5ccccc5)(c5ccccc5)c5ccccc5)c4)cn23)s1

nearest known ligand 0.52

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
FLT3 P36888 17/20 0.52
KCNH2 Q12809 1/20 0.41
MKNK1 Q9BUB5 1/20 0.37
MKNK2 Q9HBH9 1/20 0.37
PIK3CA P42336 1/20 0.36

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
SCHEMBL3850040 0.84 FLT3 (0.45) FLT3KCNH2MKNK1MKNK2
SCHEMBL3847887 0.82 FLT3 (0.43) FLT3KCNH2MKNK1MKNK2
SCHEMBL3855938 0.82 FLT3 (0.43) FLT3KCNH2MKNK1MKNK2
SCHEMBL3846437 0.82 FLT3 (0.51) FLT3KCNH2
SCHEMBL3846126 0.80 FLT3 (0.42) FLT3KCNH2
SCHEMBL3844675 0.80 FLT3 (0.43) FLT3KCNH2MKNK1MKNK2PIK3CA
SCHEMBL3847243 0.80 FLT3 (0.41) FLT3KCNH2MKNK1MKNK2
SCHEMBL3847151 0.79 FLT3 (0.41) FLT3KCNH2MKNK1MKNK2PIK3CA
SCHEMBL3845273 0.78 FLT3 (0.47) FLT3KCNH2PIK3CA
SCHEMBL3848127 0.78 FLT3 (0.40) FLT3KCNH2MKNK1MKNK2

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