SCHEMBL3849754

SCHEMBL3849754

CS(=O)(=O)c1ccc(-c2cnc3ccc(-c4c[nH]nc4-c4ccc(F)cc4F)cn23)s1

nearest known ligand 0.51

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
FLT3 P36888 11/20 0.51
TGFBR1 P36897 4/20 0.42
PIK3CA P42336 3/20 0.37
KCNH2 Q12809 1/20 0.36
PRMT5 O14744 1/20 0.35
WDR77 Q9BQA1 1/20 0.35
PIK3R1 P27986 1/20 0.35

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
Hydrochloric Acid SCHEMBL3848171 0.90 FLT3 (0.56) FLT3TGFBR1KCNH2PRMT5WDR77
Hydrochloric Acid SCHEMBL3846571 0.85 FLT3 (0.37) FLT3
Hydrochloric Acid SCHEMBL3848158 0.83 FLT3 (0.55) FLT3TGFBR1KCNH2
SCHEMBL3848209 0.82 FLT3 (0.44) FLT3TGFBR1KCNH2
SCHEMBL3847431 0.81 FLT3 (0.44) FLT3TGFBR1KCNH2
SCHEMBL3856687 0.81 FLT3 (0.46) FLT3TGFBR1KCNH2PRMT5WDR77
Hydrochloric Acid SCHEMBL3856334 0.81 FLT3 (0.48) FLT3TGFBR1KCNH2
SCHEMBL3845273 0.81 FLT3 (0.47) FLT3TGFBR1PIK3CAKCNH2
SCHEMBL3845761 0.80 FLT3 (0.42) FLT3TGFBR1KCNH2
SCHEMBL3850102 0.78 MKNK1 (0.44) FLT3PIK3CA

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 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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 claimed
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 claimed
EP-1382603-A1 NITROGENOUS FUSED−RING COMPOUND HAVING PYRAZOLYL GROUP AS SUBSTITUENT AND MEDICINAL COMPOSITION THEREOF Eisai Co., Ltd. (JP) 2004-01-21 EP claimed
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