SCHEMBL1755484

SCHEMBL1755484

COCCOc1ccc(C)cc1N

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.60
CYP3A4 P08684 2/20 0.60
L3MBTL1 Q9Y468 7/20 0.47
MAPT P10636 6/20 0.47
MEN1 O00255 3/20 0.47
KMT2A Q03164 3/20 0.47
USP2 O75604 2/20 0.47
POLB P06746 2/20 0.47
HPGD P15428 2/20 0.47
CYP2C9 P11712 1/20 0.47
ALOX12 P18054 1/20 0.47
MAPK1 P28482 1/20 0.47
CYP2C19 P33261 1/20 0.47
NPSR1 Q6W5P4 1/20 0.47
TP53 P04637 2/20 0.47
KDM4E B2RXH2 2/20 0.47
GAA P10253 1/20 0.47
CASP1 P29466 1/20 0.47
HTT P42858 1/20 0.47
CASP7 P55210 1/20 0.47

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
SCHEMBL2130143 0.95 ALDH1A1 (0.55) ALDH1A1CYP3A4L3MBTL1MAPTMEN1
SCHEMBL27808505 0.91 ALDH1A1 (0.58) ALDH1A1CYP3A4L3MBTL1MAPTMEN1
SCHEMBL12280900 0.85 ALDH1A1 (0.55) ALDH1A1CYP3A4L3MBTL1MAPTMEN1
SCHEMBL11956988 0.85 L3MBTL1 (0.47) ALDH1A1CYP3A4L3MBTL1MAPTMEN1
SCHEMBL2477531 0.83 GAA (0.68) ALDH1A1MAPTMEN1KMT2AUSP2
SCHEMBL9423697 0.83 ALDH1A1 (0.62) ALDH1A1CYP3A4L3MBTL1MAPTMEN1
SCHEMBL2426952 0.83 ALDH1A1 (0.68) ALDH1A1CYP3A4MAPTMEN1KMT2A
SCHEMBL12781859 0.82 L3MBTL1 (0.61) ALDH1A1CYP3A4L3MBTL1MAPTMEN1
SCHEMBL3094604 0.81 ALDH1A1 (0.55) ALDH1A1CYP3A4MAPTMEN1KMT2A
SCHEMBL8385763 0.81 CYP1A2 (0.59) ALDH1A1CYP3A4L3MBTL1MAPTMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1899418-B1 Disazo dyes and dye compositions for shading white paper BASF SE (DE) 2012-04-18 EP disclosed
US-7682406-B2 Disazo dyes and dye compositions for shading white paper CIBA SPECIALTY CHEMICALS CORPORATION (US) 2010-03-23 US disclosed
US-7682406-B2 Disazo dyes and dye compositions for shading white paper CIBA SPECIALTY CHEMICALS CORPORATION (US) 2010-03-23 US disclosed
US-20090083913-A1 Disazo Dyes and Dye Compositions for Shading White Paper CIBA SPECIALTY CHEMICALS CORP. 2009-04-02 US disclosed
US-20090083913-A1 Disazo Dyes and Dye Compositions for Shading White Paper CIBA SPECIALTY CHEMICALS CORP. 2009-04-02 US disclosed
WO-2007003524-A1 DISAZO DYES AND DYE COMPOSITIONS FOR SHADING WHITE PAPER CIBA SPECIALTY CHEMICALS HOLDING INC. (CH) 2007-01-11 WO disclosed
EP-0159291-A1 Ink composition for the ink-jet printing process CIBA-GEIGY AG (CH) 1985-10-23 EP disclosed
US-4118232-A Photographic material containing sulphonic acid group containing disazo dyestuffs CIBA-GEIGY AG (CH) 1978-10-03 US disclosed
US-4051123-A Sulfonic-acid-group containing disazo dyestuffs CIBA-GEIGY AG (CH) 1977-09-27 US disclosed
US-3957860-A SULFAMIC ACID CIBA-GEIGY AG (CH) 1976-05-18 US disclosed