SCHEMBL3846437

SCHEMBL3846437

CS(=O)(=O)c1ccc(-c2nn(C(c3ccccc3)(c3ccccc3)c3ccccc3)cc2-c2ccc3ncc(-c4ccc(S(C)(=O)=O)s4)n3c2)cc1

nearest known ligand 0.51

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
FLT3 P36888 12/20 0.51
KCNH2 Q12809 3/20 0.43
AKT1 P31749 1/20 0.39
AKT2 P31751 1/20 0.39
TGFBR1 P36897 1/20 0.36
PTGS2 P35354 3/20 0.35

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
SCHEMBL3847243 0.91 FLT3 (0.41) FLT3KCNH2AKT1AKT2TGFBR1
SCHEMBL3847151 0.90 FLT3 (0.41) FLT3KCNH2AKT1AKT2TGFBR1
SCHEMBL3853072 0.90 FLT3 (0.49) FLT3KCNH2AKT1AKT2TGFBR1
SCHEMBL3848127 0.89 FLT3 (0.40) FLT3KCNH2AKT1AKT2
SCHEMBL3846126 0.89 FLT3 (0.42) FLT3KCNH2TGFBR1PTGS2
SCHEMBL3850040 0.88 FLT3 (0.45) FLT3KCNH2TGFBR1
SCHEMBL3848234 0.88 MKNK1 (0.41) FLT3KCNH2PTGS2
SCHEMBL3845942 0.87 FLT3 (0.45) FLT3KCNH2AKT1AKT2TGFBR1
SCHEMBL3845273 0.86 FLT3 (0.47) FLT3KCNH2TGFBR1PTGS2
SCHEMBL3847887 0.86 FLT3 (0.43) FLT3KCNH2TGFBR1

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