SCHEMBL3846292

SCHEMBL3846292

Fc1ccc(-c2cnc3ccc(-c4cn(C(c5ccccc5)(c5ccccc5)c5ccccc5)nc4C(F)(F)F)cn23)cc1

nearest known ligand 0.45

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
FLT3 P36888 7/20 0.45
DYRK1A Q13627 3/20 0.35
DYRK2 Q92630 3/20 0.35
SCN5A Q14524 1/20 0.34
MKNK1 Q9BUB5 2/20 0.34
MKNK2 Q9HBH9 1/20 0.34
FYN P06241 1/20 0.34
PIK3CA P42336 3/20 0.34
TGFBR1 P36897 2/20 0.34
KCNH2 Q12809 1/20 0.33
MTOR P42345 1/20 0.33
DYRK3 O43781 1/20 0.33
CCNA2 P20248 1/20 0.33
CDK2 P24941 1/20 0.33
DYRK1B Q9Y463 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
SCHEMBL3846448 0.84 FLT3 (0.44) FLT3MKNK1MKNK2FYNPIK3CA
SCHEMBL3846517 0.84 TGFBR1 (0.35) DYRK1ADYRK2SCN5ATGFBR1
SCHEMBL3850397 0.83 FLT3 (0.43) FLT3FYNTGFBR1
SCHEMBL3846734 0.83 MKNK1 (0.44) FLT3MKNK1MKNK2FYNTGFBR1
SCHEMBL3846927 0.83 FLT3 (0.43) FLT3MKNK1MKNK2FYNPIK3CA
SCHEMBL3846295 0.81 FLT3 (0.36) FLT3
SCHEMBL3845957 0.81 FLT3 (0.41) FLT3MKNK1MKNK2PIK3CATGFBR1
SCHEMBL3845550 0.81 FLT3 (0.41) FLT3MKNK1MKNK2FYNTGFBR1
SCHEMBL3846108 0.81 FLT3 (0.41) FLT3MKNK1FYNTGFBR1
SCHEMBL3845520 0.81 FLT3 (0.41) FLT3MKNK1FYNTGFBR1KCNH2

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