SCHEMBL3845937

SCHEMBL3845937

C=CCOc1ccc(C23CC4CC(CC(C4)C2C2C4CC5CC(C4)CC2(c2ccc(OCC=C)cc2)C5)C3)cc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.40
MEN1 O00255 2/20 0.40
KMT2A Q03164 2/20 0.40
LMNA P02545 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
RAB9A P51151 3/20 0.38
CA12 O43570 1/20 0.37
CA1 P00915 1/20 0.37
CA2 P00918 1/20 0.37
CA7 P43166 1/20 0.37
CA9 Q16790 1/20 0.37
TSHR P16473 2/20 0.36
MMP1 P03956 1/20 0.35
MMP2 P08253 1/20 0.35
MMP9 P14780 1/20 0.35
MAPT P10636 4/20 0.35
NPC1 O15118 2/20 0.35
ADRA2A P08913 1/20 0.34
ADRA2B P18089 1/20 0.34
ADRA2C P18825 1/20 0.34

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
SCHEMBL3841450 0.81 ADRA2A (0.39) ALDH1A1MEN1KMT2ALMNACA12
SCHEMBL3843528 0.79 MEN1 (0.40) ALDH1A1MEN1KMT2ALMNAL3MBTL1
SCHEMBL3844403 0.78 MEN1 (0.45) ALDH1A1MEN1KMT2ALMNAL3MBTL1
SCHEMBL3844877 0.78 MEN1 (0.40) ALDH1A1MEN1KMT2ALMNAL3MBTL1
SCHEMBL5866811 0.75 ESR1 (0.52) ALDH1A1MEN1KMT2ALMNAL3MBTL1
SCHEMBL3844883 0.73 GAA (0.37) ALDH1A1MEN1KMT2ALMNAL3MBTL1
SCHEMBL3843190 0.72 ESR1 (0.46) ALDH1A1MEN1KMT2ALMNAL3MBTL1
SCHEMBL3842342 0.72 MEN1 (0.46) ALDH1A1MEN1KMT2ALMNAL3MBTL1
SCHEMBL3846317 0.71 GAA (0.45) ALDH1A1MEN1KMT2ALMNAMAPT
SCHEMBL3845066 0.69 ESR1 (0.46) ALDH1A1MEN1KMT2ALMNAL3MBTL1

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