SCHEMBL3848181

SCHEMBL3848181

Fc1ccc(-c2nn(C(c3ccccc3)(c3ccccc3)C3C=CC=CC3)cc2-c2ccc3ncc(-c4ccc(-c5ccccn5)s4)n3c2)cc1

nearest known ligand 0.39

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
FLT3 P36888 8/20 0.39
CSNK1D P48730 3/20 0.35
CSNK1E P49674 3/20 0.35
TGFBR1 P36897 4/20 0.31
TGFBR2 P37173 1/20 0.31
AKT1 P31749 1/20 0.30
AKT2 P31751 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
SCHEMBL3847482 0.93 TGFBR1 (0.34) FLT3CSNK1DCSNK1ETGFBR1TGFBR2
SCHEMBL3848959 0.90 FLT3 (0.38) FLT3AKT1AKT2
SCHEMBL3848401 0.90 FLT3 (0.38) FLT3AKT1AKT2
SCHEMBL3845247 0.88 FLT3 (0.31) FLT3TGFBR1TGFBR2AKT1AKT2
SCHEMBL3845547 0.88 FLT3 (0.39) FLT3
SCHEMBL3846094 0.87 FLT3 (0.38) FLT3AKT1AKT2
SCHEMBL3846605 0.87 TGFBR1 (0.37) FLT3TGFBR1TGFBR2
SCHEMBL3847290 0.85 TGFBR1 (0.35) FLT3TGFBR1TGFBR2
SCHEMBL5853410 0.85 FLT3 (0.36) FLT3TGFBR1TGFBR2
SCHEMBL3845853 0.85 FLT3 (0.36) FLT3CSNK1DCSNK1ETGFBR1TGFBR2

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