SCHEMBL3852713

SCHEMBL3852713

Brc1cnc2ccc(-c3cnn(C(c4ccccc4)(c4ccccc4)C4C=CC=CC4)c3)cn12

nearest known ligand 0.33

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
FLT3 P36888 3/20 0.33
NRAS P01111 1/20 0.33
CLK1 P49759 4/20 0.32
IRAK4 Q9NWZ3 1/20 0.30

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
SCHEMBL3848404 0.82 DYRK1A (0.38) FLT3
SCHEMBL5851881 0.80 TGFBR1 (0.37) FLT3NRASCLK1IRAK4
SCHEMBL5852367 0.79 PDE10A (0.34) FLT3NRASCLK1IRAK4
SCHEMBL3846530 0.78 TGFBR1 (0.40) FLT3NRASCLK1IRAK4
SCHEMBL3852711 0.78 CLK1 (0.36) FLT3NRASCLK1IRAK4
SCHEMBL3847098 0.76 AKT1 (0.33)
SCHEMBL3328639 0.74 CLK1 (0.36) FLT3NRASCLK1IRAK4
SCHEMBL3844955 0.74 MET (0.32)
SCHEMBL3852870 0.72 TGFBR1 (0.32)
SCHEMBL3850259 0.72

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