SCHEMBL1884566

SCHEMBL1884566

COc1cc([N+](=O)[O-])ccc1NN=C(C(C)=O)C(=O)Nc1cc(CCNC(C)=O)ccc1OC

nearest known ligand 0.48

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 6/20 0.48
KMT2A Q03164 6/20 0.48
MAPT P10636 3/20 0.48
SMN1; SMN2 Q16637 3/20 0.48
ALDH1A1 P00352 3/20 0.46
LMNA P02545 2/20 0.46
HTT P42858 2/20 0.46
EPHX1 P07099 1/20 0.46
PKM P14618 1/20 0.45

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
SCHEMBL12638044 1.00 MEN1 (0.48) MEN1KMT2AMAPTSMN1; SMN2ALDH1A1
SCHEMBL1884565 1.00 MEN1 (0.48) MEN1KMT2AMAPTSMN1; SMN2ALDH1A1
SCHEMBL12638062 0.89 ALDH1A1 (0.48) MEN1KMT2AMAPTSMN1; SMN2ALDH1A1
SCHEMBL1880162 0.89 ALDH1A1 (0.48) MEN1KMT2AMAPTSMN1; SMN2ALDH1A1
SCHEMBL1880156 0.89 ALDH1A1 (0.48) MEN1KMT2AMAPTSMN1; SMN2ALDH1A1
SCHEMBL1879164 0.85 CYP1A2 (0.42) MEN1KMT2AMAPTSMN1; SMN2ALDH1A1
SCHEMBL1879163 0.85 CYP1A2 (0.42) MEN1KMT2AMAPTSMN1; SMN2ALDH1A1
SCHEMBL13707237 0.81 PKM (0.57) MEN1KMT2AMAPTSMN1; SMN2ALDH1A1
SCHEMBL12299506 0.76 CRHBP (0.53) MEN1KMT2AMAPTALDH1A1LMNA
SCHEMBL15244989 0.75 ALDH1A1 (0.56) MEN1KMT2AMAPTSMN1; SMN2ALDH1A1

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
US-20110207860-A1 Inkjet Ink Compositions Comprising Polymeric Dispersants Having Attached Chromophore Groups CABOT CORPORATION (US) 2011-08-25 US disclosed
US-7947761-B2 Inkjet ink compositions comprising polymeric dispersants having attached chromophore groups CABOT CORPORATION (US) 2011-05-24 US disclosed
EP-1981943-A1 INKJET INK COMPOSITIONS COMPRISING POLYMERIC DISPERSANTS HAVING ATTACHED CHROMOPHORE GROUPS Cabot Corporation (US) 2008-10-22 EP disclosed
WO-2007089859-A1 INKJET INK COMPOSITIONS COMPRISING POLYMERIC DISPERSANTS HAVING ATTACHED CHROMOPHORE GROUPS CABOT CORPORATION (US) 2007-08-09 WO disclosed
US-20070179215-A1 Inkjet ink compositions comprising polymeric dispersants having attached chromophore groups CABOT CORPORATION 2007-08-02 US disclosed
US-20070179214-A1 Inkjet ink compositions comprising polymeric dispersants having attached chromophore groups CABOT CORPORATION 2007-08-02 US disclosed
US-20070179213-A1 Inkjet ink compositions comprising polymeric dispersants having attached chromophore groups CABOT CORPORATION 2007-08-02 US disclosed