SCHEMBL15430909

SCHEMBL15430909

CCOC(=O)c1cc(C2(CC(C)C)c3cc(Br)ccc3-c3ccc(Br)cc32)ccc1OCCOCCOCCOC

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTT P42858 1/20 0.38
SMN1; SMN2 Q16637 2/20 0.34
ALDH1A1 P00352 1/20 0.34
NPSR1 Q6W5P4 2/20 0.34
RXFP1 Q9HBX9 2/20 0.34
L3MBTL1 Q9Y468 2/20 0.34
HPGD P15428 1/20 0.34
KMT2A Q03164 3/20 0.33
GAA P10253 2/20 0.33
MEN1 O00255 2/20 0.33
SMAD3 P84022 2/20 0.33
ESR1 P03372 1/20 0.33
KDM4E B2RXH2 3/20 0.33
MAPK1 P28482 1/20 0.33
MAPT P10636 2/20 0.32
GABRA1 P14867 1/20 0.32
GABRB1 P18505 1/20 0.32
GABRA3 P34903 1/20 0.32
GABRB2 P47870 1/20 0.32
THRB P10828 1/20 0.32

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
SCHEMBL563512 0.87 HTT (0.37) HTTSMN1; SMN2ALDH1A1NPSR1HPGD
SCHEMBL10322006 0.87 HTT (0.37) HTTSMN1; SMN2ALDH1A1NPSR1HPGD
SCHEMBL14929237 0.86 HTT (0.37) HTTSMN1; SMN2ALDH1A1NPSR1HPGD
SCHEMBL15430911 0.84 AAK1 (0.33)
SCHEMBL15965503 0.82 PDK2 (0.34) HTTSMN1; SMN2ALDH1A1HPGDKMT2A
SCHEMBL17807618 0.82 HTT (0.35) HTTSMN1; SMN2ALDH1A1L3MBTL1HPGD
SCHEMBL15430908 0.81 CA12 (0.45) SMN1; SMN2ALDH1A1NPSR1RXFP1KMT2A
SCHEMBL19996767 0.80 HTT (0.33) HTTSMN1; SMN2ALDH1A1KMT2AMEN1
SCHEMBL18506630 0.80 HTT (0.33) HTTSMN1; SMN2ALDH1A1KMT2AMEN1
SCHEMBL10111239 0.79 TSHR (0.32) HTTSMN1; SMN2ALDH1A1KMT2AMEN1

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-9520569-B2 Aryl compounds for application in a highly polar solvent SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2016-12-13 US disclosed
US-9520569-B2 Aryl compounds for application in a highly polar solvent SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2016-12-13 US disclosed
US-9306169-B2 Electronic device, polymer compound, organic compound, and method of producing polymer compound SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2016-04-05 US disclosed
US-9306169-B2 Electronic device, polymer compound, organic compound, and method of producing polymer compound SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2016-04-05 US disclosed
US-20140231717-A1 COMPOUND SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2014-08-21 US disclosed
US-20140231717-A1 COMPOUND SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2014-08-21 US disclosed
EP-2693508-A1 ELECTRONIC DEVICE, POLYMER COMPOUND, ORGANIC COMPOUND, AND METHOD OF PRODUCING POLYMER COMPOUND Sumitomo Chemical Company Limited (JP) 2014-02-05 EP disclosed
US-20140024785-A1 ELECTRONIC DEVICE, POLYMER COMPOUND, ORGANIC COMPOUND, AND METHOD OF PRODUCING POLYMER COMPOUND SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2014-01-23 US disclosed
US-20140024785-A1 ELECTRONIC DEVICE, POLYMER COMPOUND, ORGANIC COMPOUND, AND METHOD OF PRODUCING POLYMER COMPOUND SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2014-01-23 US disclosed