SCHEMBL3844136

SCHEMBL3844136

C=CCOc1ccc(C23CC4CC(C2)CC(C25CC6CC(CC(c7ccc(OCC=C)cc7OCC=C)(C6)C2)C5)(C4)C3)c(OCC=C)c1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADRA2A P08913 3/20 0.39
ADRA2B P18089 3/20 0.39
ADRA2C P18825 3/20 0.39
KMT2A Q03164 3/20 0.34
MEN1 O00255 2/20 0.34
LMNA P02545 2/20 0.34
MAPT P10636 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
ALDH1A1 P00352 4/20 0.34
CA12 O43570 5/20 0.33
CA1 P00915 5/20 0.33
CA9 Q16790 5/20 0.33
HTR2A P28223 5/20 0.31
HTR2C P28335 5/20 0.31
HTR2B P41595 3/20 0.31
ADRB2 P07550 2/20 0.31
HTR1A P08908 2/20 0.31
CHRM5 P08912 2/20 0.31
DRD2 P14416 2/20 0.31
DRD4 P21917 2/20 0.31

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
SCHEMBL3850561 0.96 ADRA2A (0.36) ADRA2AADRA2BADRA2CKMT2AMEN1
SCHEMBL3850534 0.95 ADRA2A (0.36) ADRA2AADRA2BADRA2CKMT2AMEN1
SCHEMBL3841200 0.90 ADRA2A (0.36) ADRA2AADRA2BADRA2CKMT2AMEN1
SCHEMBL3845880 0.89 ADRA2A (0.39) ADRA2AADRA2BADRA2CKMT2AMEN1
SCHEMBL3845920 0.87 ADRA2A (0.38) ADRA2AADRA2BADRA2CKMT2AMEN1
SCHEMBL3840976 0.83 ADRA2A (0.44) ADRA2AADRA2BADRA2CKMT2AMEN1
SCHEMBL3844825 0.82 ADRA2A (0.33) ADRA2AADRA2BADRA2C
SCHEMBL3843190 0.81 ESR1 (0.46) KMT2AMEN1LMNASMN1; SMN2ALDH1A1
SCHEMBL3849520 0.78 KMT2A (0.34) KMT2AMEN1LMNAALDH1A1CA12
SCHEMBL3845066 0.78 ESR1 (0.46) KMT2AMEN1LMNAMAPTSMN1; 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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