SCHEMBL3846737

SCHEMBL3846737

Oc1ccc(-c2cnc3ccc(-c4cn(C(c5ccccc5)(c5ccccc5)C5C=CC=CC5)nc4-c4ccc(F)cc4)cn23)cc1

nearest known ligand 0.36

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MKNK1 Q9BUB5 2/20 0.36
MKNK2 Q9HBH9 2/20 0.36
FLT3 P36888 3/20 0.35
AKT1 P31749 1/20 0.34
AKT2 P31751 1/20 0.34
PIM1 P11309 1/20 0.33
FYN P06241 5/20 0.32
TGFBR1 P36897 5/20 0.32
TGFBR2 P37173 1/20 0.32

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
SCHEMBL3850400 0.92 FLT3 (0.35) FLT3AKT1AKT2FYNTGFBR1
SCHEMBL3845555 0.92 TGFBR1 (0.33) MKNK1MKNK2FLT3AKT1AKT2
SCHEMBL3846112 0.91 FLT3 (0.34) FLT3AKT1AKT2FYNTGFBR1
SCHEMBL3846452 0.91 FLT3 (0.36) FLT3AKT1AKT2TGFBR1
SCHEMBL3848375 0.90 FYN (0.38) MKNK1MKNK2AKT1AKT2FYN
SCHEMBL3849709 0.90 FLT3 (0.38) FLT3AKT1AKT2FYNTGFBR1
SCHEMBL3845523 0.90 FLT3 (0.33) FLT3AKT1AKT2TGFBR1TGFBR2
SCHEMBL3845960 0.90 TGFBR1 (0.36) MKNK1MKNK2FLT3AKT1AKT2
SCHEMBL3845247 0.90 FLT3 (0.31) FLT3AKT1AKT2TGFBR1TGFBR2
SCHEMBL3846929 0.89 FLT3 (0.35) FLT3

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