SCHEMBL4624237

SCHEMBL4624237

CCCCCCCCCCCCc1[c]cc(CCCCCCCCCCCC)[c]c1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 4/20 0.40
ESR1 P03372 2/20 0.40
ADRA2A P08913 2/20 0.40
ADORA3 P0DMS8 2/20 0.40
TACR2 P21452 2/20 0.40
SLC6A2 P23975 2/20 0.40
SLC6A4 P31645 2/20 0.40
SLC6A3 Q01959 2/20 0.40
KCNH2 Q12809 2/20 0.40
CYP3A4 P08684 2/20 0.40
ACHE P22303 2/20 0.40
KDM4E B2RXH2 1/20 0.40
ALDH1A1 P00352 1/20 0.40
LMNA P02545 1/20 0.40
SHBG P04278 1/20 0.40
TP53 P04637 1/20 0.40
HSPD1 P10809 1/20 0.40
ADRB3 P13945 1/20 0.40
HTR2C P28335 1/20 0.40
HSPE1 P61604 1/20 0.40

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
SCHEMBL1243639 1.00 PTGS2 (0.40) PTGS2ESR1ADRA2AADORA3TACR2
SCHEMBL3277113 1.00 PTGS2 (0.40) PTGS2ESR1ADRA2AADORA3TACR2
SCHEMBL2883267 1.00 PTGS2 (0.40) PTGS2ESR1ADRA2AADORA3TACR2
SCHEMBL4623440 1.00 PTGS2 (0.40) PTGS2ESR1ADRA2AADORA3TACR2
SCHEMBL8390626 0.89 PTGS2 (0.34) PTGS2ESR1ADRA2AADORA3TACR2
SCHEMBL3423379 0.81 PTGS2 (0.34) PTGS2ESR1ADRA2AADORA3TACR2
SCHEMBL1717330 0.81 PTGS2 (0.34) PTGS2ESR1ADRA2AADORA3TACR2
SCHEMBL1717457 0.81 PTGS2 (0.34) PTGS2ESR1ADRA2AADORA3TACR2
SCHEMBL7570539 0.81 PTGS2 (0.34) PTGS2ESR1ADRA2AADORA3TACR2
SCHEMBL11787936 0.81 PTGS2 (0.34) PTGS2ESR1ADRA2AADORA3TACR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0443861-B2 Organic electroluminescence device SUMITOMO CHEMICAL CO (JP) 2008-05-28 EP disclosed
EP-0644217-B1 A process for producing polymers of alpha,omega-unsaturated conjugated compounds, and high molecular weight conjugated polymers thus obtainable COVION ORGANIC SEMICONDUCTORS (DE) 2004-06-09 EP disclosed
EP-0705857-B1 A process for producing polymers of alpha,omega-unsaturated conjugated compounds AVENTIS RES & TECH GMBH & CO (DE) 2000-01-19 EP disclosed
US-5917003-A Process for producing polymers of α,ω-unsaturated conjugated compounds, and high molecular weight conjugated polymers thus obtainable HOECHST AKTIENGESELLSCHAFT (DE) 1999-06-29 US disclosed
US-5763539-A Process for producing polymers of α,ω-unsaturated conjugated compounds HOECHST AKTIENGESELLSCHAFT (DE) 1998-06-09 US disclosed
US-5726457-A POLYARYLENEVINYLENES SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1998-03-10 US disclosed
EP-0705857-A2 A process for producing polymers of alpha,omega-unsaturated conjugated compounds HOECHST AKTIENGESELLSCHAFT (DE) 1996-04-10 EP disclosed
EP-0443861-B1 Organic electroluminescence device SUMITOMO CHEMICAL CO (JP) 1995-07-05 EP disclosed
EP-0644217-A1 A process for producing polymers of alpha,omega-unsaturated conjugated compounds, and high molecular weight conjugated polymers thus obtainable HOECHST AKTIENGESELLSCHAFT (DE) 1995-03-22 EP disclosed
US-5317169-A Using a polyarylenevinylene as a light emitting layer; uniformity of emission over a large surface; efficiency SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1994-05-31 US disclosed
EP-0443861-A2 Organic electroluminescence device SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1991-08-28 EP disclosed
EP-0200185-B1 THERMOPLASTIC MOULDING MASS BASF Aktiengesellschaft (DE) 1988-11-30 EP disclosed