SCHEMBL4403176

SCHEMBL4403176

Cc1ccc(N=C2C=CC(=Nc3ccc(C)cc3)C=C2)cc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ACHE P22303 4/20 0.44
TDP1 Q9NUW8 2/20 0.44
MAPT P10636 4/20 0.44
ALDH1A1 P00352 3/20 0.44
HPGD P15428 2/20 0.44
KDM4E B2RXH2 1/20 0.44
GLA P06280 1/20 0.44
ALOX12 P18054 1/20 0.44
HK1 P19367 1/20 0.44
MPI P34949 1/20 0.44
CACNA1B Q00975 1/20 0.44
APBA1 Q02410 1/20 0.44
HKDC1 Q2TB90 1/20 0.44
APOBEC3G Q9HC16 1/20 0.44
HTR3E A5X5Y0 2/20 0.42
HTR3B O95264 2/20 0.42
HTR3A P46098 2/20 0.42
HTR3D Q70Z44 2/20 0.42
HTR3C Q8WXA8 2/20 0.42
SLC22A2 O15244 1/20 0.42

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
SCHEMBL20198346 0.91 ALOX12 (0.43) ACHETDP1MAPTALDH1A1HPGD
SCHEMBL821944 0.91 MAPT (0.39) ACHETDP1MAPTALDH1A1HPGD
SCHEMBL677862 0.91 MAPT (0.39) ACHETDP1MAPTALDH1A1HPGD
SCHEMBL12309398 0.91 MAPT (0.39) ACHETDP1MAPTALDH1A1HPGD
SCHEMBL12761442 0.89 MAPT (0.38) ACHETDP1MAPTALDH1A1HPGD
SCHEMBL17228771 0.89 ACHE (0.56) ACHETDP1MAPTALDH1A1HPGD
SCHEMBL14594146 0.87 HPGD (0.50) TDP1MAPTALDH1A1HPGDKDM4E
SCHEMBL13695284 0.85 MAPT (0.36) ACHETDP1MAPTALDH1A1HPGD
SCHEMBL10296205 0.84 HTR3E (0.35) ACHETDP1MAPTALDH1A1HPGD
SCHEMBL14700433 0.80 HPGD (0.44) TDP1MAPTALDH1A1HPGDKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118325078-A Preparation method and application of benzoquinone conjugated polymer 中国科学院宁波材料技术与工程研究所 2024-07-12 CN disclosed
EP-1675930-B1 NEW MATERIALS FOR ELECTROLUMINESCENCE AND THE UTILIZATION THEREOF MERCK PATENT GMBH (DE) 2018-05-30 EP disclosed
US-8173276-B2 Materials for electroluminescence and the utilization thereof MERCK PATENT GMBH (DE) 2012-05-08 US disclosed
US-20100102305-A1 MATERIALS FOR ELECTROLUMINESCENCE AND THE UTILIZATION THEREOF MERCK PATENT GMBH (DE) 2010-04-29 US disclosed
US-7659540-B2 Materials for electroluminescence and the utilization thereof MERCK PATENT GMBH (DE) 2010-02-09 US disclosed
US-7659540-B2 Materials for electroluminescence and the utilization thereof MERCK PATENT GMBH (DE) 2010-02-09 US disclosed
US-20070080343-A1 New materials for electroluminescence and the utilization thereof MERCK PATENT GMBH (DE) 2007-04-12 US disclosed
US-20070080343-A1 New materials for electroluminescence and the utilization thereof MERCK PATENT GMBH (DE) 2007-04-12 US disclosed