SCHEMBL6890328

SCHEMBL6890328

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

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.40
KMT2A Q03164 3/20 0.40
ESR1 P03372 1/20 0.40
AR P10275 1/20 0.38
ABCB1 P08183 1/20 0.38
MAPT P10636 2/20 0.36
SMN1; SMN2 Q16637 2/20 0.36
HTT P42858 1/20 0.36
FGFR1 P11362 1/20 0.36
MAPK1 P28482 2/20 0.36
TSHR P16473 1/20 0.36
POLB P06746 2/20 0.35
LMNA P02545 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35
ACSS2 Q9NR19 1/20 0.35
ALDH1A1 P00352 1/20 0.35
HPGD P15428 1/20 0.35
KCNA5 P22460 1/20 0.35
KCNH2 Q12809 1/20 0.35
KDM4E B2RXH2 1/20 0.35

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
SCHEMBL14173940 0.83 SMN1; SMN2 (0.49) MEN1KMT2AARMAPTSMN1; SMN2
SCHEMBL14173716 0.83 SMN1; SMN2 (0.49) MEN1KMT2AARMAPTSMN1; SMN2
SCHEMBL14174090 0.83 SMN1; SMN2 (0.49) MEN1KMT2AARMAPTSMN1; SMN2
SCHEMBL14174096 0.83 SMN1; SMN2 (0.49) MEN1KMT2AARMAPTSMN1; SMN2
SCHEMBL14174097 0.80 MAPT (0.49) MEN1KMT2AARMAPTSMN1; SMN2
SCHEMBL14173797 0.80 MAPT (0.49) MEN1KMT2AARMAPTSMN1; SMN2
SCHEMBL14174093 0.80 MAPT (0.49) MEN1KMT2AARMAPTSMN1; SMN2
SCHEMBL12269328 0.80 MAPT (0.49) MEN1KMT2AARMAPTSMN1; SMN2
SCHEMBL14173961 0.80 MAPT (0.49) MEN1KMT2AARMAPTSMN1; SMN2
SCHEMBL2400649 0.80 MAPT (0.49) MEN1KMT2AARMAPTSMN1; SMN2

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