SCHEMBL6888049

SCHEMBL6888049

N#CC(C#N)=C(C#N)c1ccc(N(c2ccccc2)c2ccc(CC(CO)CO)cc2)cc1

nearest known ligand 0.43

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.43
KMT2A Q03164 3/20 0.43
EGFR P00533 2/20 0.34
ACSS2 Q9NR19 1/20 0.31
PTPN1 P18031 1/20 0.30
ESR1 P03372 1/20 0.30
NPC1 O15118 1/20 0.30
CTSB P07858 1/20 0.30

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
SCHEMBL8722337 0.83 MEN1 (0.59) MEN1KMT2AEGFRESR1
SCHEMBL8720916 0.82 KMT2A (0.37) MEN1KMT2ACTSB
SCHEMBL8720901 0.82 KMT2A (0.47) MEN1KMT2AACSS2
SCHEMBL6890328 0.76 MEN1 (0.40) MEN1KMT2AACSS2ESR1
SCHEMBL17152711 0.75 MEN1 (0.50) MEN1KMT2AEGFRESR1NPC1
SCHEMBL14744144 0.75 MEN1 (0.46) MEN1KMT2AESR1NPC1
SCHEMBL14744143 0.75 MEN1 (0.46) MEN1KMT2AESR1NPC1
SCHEMBL21183309 0.75 APP (0.38) MEN1KMT2AACSS2ESR1
SCHEMBL18784036 0.74 MEN1 (0.51) MEN1KMT2AEGFRESR1
SCHEMBL17152746 0.72 MEN1 (0.54) MEN1KMT2AEGFRESR1NPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6759147-B2 HIGH INTENSITY, STABILITY; CHARGE TRANSFER COMPOUNDS; CHARGE GENERATING COMPOUNDS KONINKLIJKE PHILIPS ELECTRONICS N.V. (NL) 2004-07-06 US disclosed
US-20020168546-A1 Electroluminescent device KONINKLIJKE PHILIPS ELECTRONICS, N.V. 2002-11-14 US disclosed
US-6432560-B1 ACTIVE MATERIAL IN POLYMER MATRIX KONINKLIJKE PHILIPS ELECTRONICS N.V. (NL) 2002-08-13 US disclosed
EP-1105927-A2 ELECTROLUMINESCENT DEVICE Koninklijke Philips Electronics N.V. (NL) 2001-06-13 EP disclosed
WO-2000065881-A2 ELECTROLUMINESCENT DEVICE KONINKLIJKE PHILIPS ELECTRONICS N.V. (NL) 2000-11-02 WO disclosed
EP-0868682-A1 ELECTRO- OR OPTO-OPTICAL DEVICE STABLE IN THE 600-1600 NANOMETER WAVELENGTH RANGE Akzo Nobel N.V. (NL) 1998-10-07 EP disclosed
US-5776375-A CONTAINING NONLINEAR OPTICALLY ACTIVE POLYMER AKZO NOBEL N.V. (NL) 1998-07-07 US disclosed
WO-1997023807-A1 ELECTRO- OR OPTO-OPTICAL DEVICE STABLE IN THE 600-1600 NANOMETER WAVELENGTH RANGE AKZO NOBEL N.V. (NL) 1997-07-03 WO disclosed
EP-0780722-A1 Electro-optical device stable in the 600-1600 nanometer wavelength range Akzo Nobel N.V. (NL) 1997-06-25 EP disclosed