SCHEMBL3840978

SCHEMBL3840978

C=CCOc1[c]c(OCC=C)ccc1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 1/20 0.38
TSHR P16473 1/20 0.38
MAPK1 P28482 1/20 0.38
HSD17B10 Q99714 1/20 0.38
CYP3A4 P08684 2/20 0.38
CYP2A6 P11509 1/20 0.38
PTPRC P08575 1/20 0.37
ADRA2A P08913 1/20 0.37
ADRA2B P18089 1/20 0.37
ADRA2C P18825 1/20 0.37
CA12 O43570 3/20 0.36
CA1 P00915 3/20 0.36
CA9 Q16790 3/20 0.36
CA2 P00918 1/20 0.36
CA7 P43166 1/20 0.36
LIG1 P18858 1/20 0.36
TLR4 O00206 1/20 0.35
MAPT P10636 2/20 0.33
MEN1 O00255 1/20 0.33
LMNA P02545 1/20 0.33

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
SCHEMBL1990168 0.86 TSHR (0.34) HPGDTSHRMAPK1HSD17B10CYP3A4
SCHEMBL15068118 0.86 ADRA2A (0.36) HPGDTSHRMAPK1HSD17B10CYP3A4
SCHEMBL15067115 0.86 MAPT (0.35) HPGDTSHRMAPK1HSD17B10CYP3A4
SCHEMBL17460051 0.82 AGER (0.35) HPGDTSHRMAPK1HSD17B10CYP3A4
SCHEMBL11241339 0.79 CA12 (0.34) CYP3A4CYP2A6PTPRCCA12CA1
SCHEMBL482463 0.77 HPGD (0.39) HPGDTSHRMAPK1HSD17B10CYP3A4
SCHEMBL5888901 0.76 MEN1 (0.40) HPGDADRA2AADRA2BADRA2CCA12
SCHEMBL5888944 0.75 HPGD (0.39) HPGDTSHRMAPK1HSD17B10CYP3A4
SCHEMBL3263964 0.75 SMN1; SMN2 (0.35) MAPTMEN1LMNAKMT2ASMN1; SMN2
SCHEMBL15066511 0.74 HTR2C (0.39) HPGDTSHRMAPK1HSD17B10ADRA2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7041388-B1 Substituted poly(arylene vinylenes), process for their preparation and their use in electroluminescent devices SEMICONDUCTORS GMBH (DE) 2006-05-09 US claimed
US-20090318610-A1 ORGANIC INSULATING MATERIALS, VARNISHES FOR ORGANIC INSULATING FILM EMPLOYING THEM, ORGANIC INSULATING FILMS AND SEMICONDUCTOR DEVICES SUMITOMO BAKELITE CO., LTD (JP) 2009-12-24 US disclosed
EP-2117009-A1 ORGANIC INSULATING MATERIAL, VARNISH FOR ORGANIC INSULATING FILM USING THE SAME, ORGANIC INSULATING FILM AND SEMICONDUCTOR DEVICE Sumitomo Bakelite Co., Ltd. (JP) 2009-11-11 EP disclosed