SCHEMBL11948839

SCHEMBL11948839

CCN(c1ccc(/N=N/c2snc3ccc([N+](=O)[O-])cc23)c(C)c1)C(C)CN1C(=O)c2ccccc2C1=O

nearest known ligand 0.34

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.34
MEN1 O00255 3/20 0.34
KMT2A Q03164 3/20 0.34
POLB P06746 2/20 0.34
MAPT P10636 1/20 0.34
KDR P35968 1/20 0.34
HTR1A P08908 1/20 0.33
GAA P10253 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
RPS6KA2 Q15349 1/20 0.32
L3MBTL1 Q9Y468 2/20 0.31
KDM4E B2RXH2 1/20 0.31

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
SCHEMBL11948834 0.86 ALDH1A1 (0.38) ALDH1A1MEN1KMT2APOLBHTR1A
SCHEMBL11948829 0.85 ALDH1A1 (0.43) ALDH1A1MEN1KMT2AHTR1AGAA
SCHEMBL11948835 0.84 ALDH1A1 (0.46) ALDH1A1MEN1KMT2AHTR1AGAA
SCHEMBL11948837 0.83 KDR (0.42) ALDH1A1MEN1KMT2APOLBKDR
SCHEMBL24046231 0.81 KDR (0.39) ALDH1A1MEN1KMT2APOLBMAPT
SCHEMBL11948838 0.81 POLB (0.39) ALDH1A1MEN1KMT2APOLBHTR1A
SCHEMBL18179596 0.80 KDR (0.44) ALDH1A1MEN1KMT2APOLBMAPT
SCHEMBL11948812 0.79 KDR (0.40) ALDH1A1MEN1KMT2APOLBMAPT
SCHEMBL11948750 0.79 ALDH1A1 (0.36) ALDH1A1MEN1KMT2APOLBMAPT
SCHEMBL24046221 0.78 MAPT (0.44) ALDH1A1MEN1KMT2APOLBMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2167496-B1 AZO DYES HUNTSMAN ADV MAT SWITZERLAND (CH) 2014-09-24 EP disclosed
US-8231691-B2 Azo dyes HUNTSMAN INTERNATIONAL LLC (US) 2012-07-31 US disclosed
US-8231691-B2 Azo dyes HUNTSMAN INTERNATIONAL LLC (US) 2012-07-31 US disclosed
US-20100196676-A1 AZO DYES HUNTSMAN INTERNATIONAL LLC (US) 2010-08-05 US disclosed
US-20100196676-A1 AZO DYES HUNTSMAN INTERNATIONAL LLC (US) 2010-08-05 US disclosed
WO-2009013122-A2 AZO DYES HUNTSMAN ADVANCED MATERIALS (SWITZERLAND) GMBH (CH) 2009-01-29 WO disclosed