SCHEMBL10033596

SCHEMBL10033596

Cn1c(=O)c(C(=O)c2ccccc2)c2c3c(c(Nc4ccc(S(=O)(=O)O)cc4)ccc31)C(=O)c1ccccc1-2

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAP3K5 Q99683 1/20 0.57
MAPT P10636 6/20 0.49
PABPC1 P11940 3/20 0.49
SMN1; SMN2 Q16637 2/20 0.49
NR4A1 P22736 1/20 0.48
MAPK1 P28482 4/20 0.46
CYP1A2 P05177 3/20 0.46
LMNA P02545 2/20 0.46
CYP2C19 P33261 2/20 0.46
HIF1A Q16665 1/20 0.46
HSD17B10 Q99714 1/20 0.46
MEN1 O00255 8/20 0.43
KMT2A Q03164 8/20 0.43
POLB P06746 4/20 0.43
L3MBTL1 Q9Y468 3/20 0.43
PTPRA P18433 1/20 0.43
PTPRB P23467 1/20 0.43
USP2 O75604 3/20 0.42
GAA P10253 2/20 0.42
PKM P14618 1/20 0.42

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
SCHEMBL13382722 0.92 MAPT (0.51) MAP3K5MAPTPABPC1SMN1; SMN2NR4A1
SCHEMBL138484 0.91 MAP3K5 (0.65) MAP3K5MAPTPABPC1SMN1; SMN2NR4A1
SCHEMBL14559159 0.90 MAP3K5 (0.61) MAP3K5MAPTPABPC1SMN1; SMN2NR4A1
SCHEMBL12744414 0.88 MAP3K5 (0.54) MAP3K5MAPTPABPC1SMN1; SMN2NR4A1
SCHEMBL13940758 0.87 MAP3K5 (0.45) MAP3K5MAPTPABPC1SMN1; SMN2NR4A1
SCHEMBL17808464 0.86 MAP3K5 (0.56) MAP3K5MAPTPABPC1SMN1; SMN2NR4A1
SCHEMBL11891998 0.86 MAP3K5 (0.52) MAP3K5MAPTPABPC1SMN1; SMN2NR4A1
SCHEMBL16124826 0.85 MEN1 (0.60) MAP3K5MAPTPABPC1SMN1; SMN2NR4A1
SCHEMBL17808610 0.85 MAP3K5 (0.49) MAP3K5MAPTPABPC1SMN1; SMN2NR4A1
SCHEMBL17808609 0.85 NR4A1 (0.52) MAP3K5MAPTPABPC1SMN1; SMN2NR4A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170247544-A1 COLORING COMPOSITION FOR TEXTILE PRINTING, TEXTILE PRINTING METHOD, INK FOR INK JET TEXTILE PRINTING, AND DYED FABRIC FUJIFILM CORPORATION (JP) 2017-08-31 US disclosed
US-20160160065-A1 INK COMPOSITION, INK JET RECORDING METHOD USING SAME, AND COLORED MATERIAL NIPPON KAYAKU KABUSHIKI KAISHA (JP) 2016-06-09 US disclosed
US-20120050381-A1 INK JET INK COMPOSITION, INK JET RECORDING METHOD, INK CARTRIDGE, RECORDING UNIT, AND INK JET RECORDING APPARATUS SONY CORPORATION (JP) 2012-03-01 US disclosed
US-7229166-B2 Image-forming method, image-forming apparatus, ink set, and ink CANON KABUSHIKI KAISHA (JP) 2007-06-12 US disclosed
US-7229166-B2 Image-forming method, image-forming apparatus, ink set, and ink CANON KABUSHIKI KAISHA (JP) 2007-06-12 US disclosed