SCHEMBL3846734

SCHEMBL3846734

Oc1ccc(-c2cnc3ccc(-c4cn(C(c5ccccc5)(c5ccccc5)c5ccccc5)nc4-c4ccc(F)cc4)cn23)cc1

nearest known ligand 0.44

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MKNK1 Q9BUB5 4/20 0.44
MKNK2 Q9HBH9 3/20 0.44
FLT3 P36888 2/20 0.43
PIM1 P11309 1/20 0.39
AKT1 P31749 1/20 0.38
AKT2 P31751 1/20 0.38
FYN P06241 8/20 0.38
TGFBR1 P36897 5/20 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
SCHEMBL3850397 0.90 FLT3 (0.43) FLT3AKT1AKT2FYNTGFBR1
SCHEMBL3845550 0.90 FLT3 (0.41) MKNK1MKNK2FLT3AKT1AKT2
SCHEMBL3846448 0.88 FLT3 (0.44) MKNK1MKNK2FLT3AKT1AKT2
SCHEMBL3848374 0.88 FYN (0.45) MKNK1MKNK2FLT3AKT1AKT2
SCHEMBL3845520 0.88 FLT3 (0.41) MKNK1FLT3AKT1AKT2FYN
SCHEMBL3845957 0.88 FLT3 (0.41) MKNK1MKNK2FLT3AKT1AKT2
SCHEMBL3846767 0.88 FYN (0.51) MKNK1MKNK2FLT3AKT1AKT2
SCHEMBL3849706 0.88 FLT3 (0.46) FLT3AKT1AKT2FYN
SCHEMBL3846108 0.88 FLT3 (0.41) MKNK1FLT3AKT1AKT2FYN
SCHEMBL3845245 0.87 FLT3 (0.39) FLT3AKT1AKT2TGFBR1

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