SCHEMBL3856687

SCHEMBL3856687

CS(=O)(=O)c1ccc(-c2cnc3ccc(-c4c[nH]nc4-c4ccc(CN)cc4)cn23)s1

nearest known ligand 0.46

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
FLT3 P36888 12/20 0.46
CHEK1 O14757 1/20 0.39
CHEK2 O96017 1/20 0.39
ABL1 P00519 1/20 0.39
KCNH2 Q12809 1/20 0.37
PRMT5 O14744 4/20 0.36
WDR77 Q9BQA1 4/20 0.36
MKNK1 Q9BUB5 1/20 0.34
MKNK2 Q9HBH9 1/20 0.34
TGFBR1 P36897 1/20 0.33

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
SCHEMBL3845761 0.90 FLT3 (0.42) FLT3KCNH2MKNK1MKNK2TGFBR1
Hydrochloric Acid SCHEMBL3848158 0.88 FLT3 (0.55) FLT3KCNH2MKNK1MKNK2TGFBR1
Hydrochloric Acid SCHEMBL3848171 0.88 FLT3 (0.56) FLT3KCNH2PRMT5WDR77MKNK1
SCHEMBL3848209 0.87 FLT3 (0.44) FLT3KCNH2MKNK1MKNK2TGFBR1
SCHEMBL3847431 0.84 FLT3 (0.44) FLT3KCNH2TGFBR1
SCHEMBL3850102 0.83 MKNK1 (0.44) FLT3MKNK1MKNK2
Hydrochloric Acid SCHEMBL3856334 0.82 FLT3 (0.48) FLT3KCNH2MKNK1MKNK2TGFBR1
SCHEMBL3849754 0.81 FLT3 (0.51) FLT3KCNH2PRMT5WDR77TGFBR1
Hydrochloric Acid SCHEMBL5852095 0.80 FLT3 (0.45) FLT3KCNH2MKNK1MKNK2TGFBR1
Hydrochloric Acid SCHEMBL3847141 0.79 FLT3 (0.46) FLT3KCNH2PRMT5WDR77MKNK1

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