SCHEMBL3840640

SCHEMBL3840640

C#CCOc1ccc(C23CC4CC(C2)CC(C2C5CC6CC(C5)CC2(c2ccc(OCC#C)cc2)C6)(C4)C3)cc1

nearest known ligand 0.40

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 4/20 0.40
KMT2A Q03164 4/20 0.40
LMNA P02545 4/20 0.40
ALDH1A1 P00352 2/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
ESR1 P03372 1/20 0.39
RAB9A P51151 1/20 0.39
HIF1A Q16665 5/20 0.38
MDH2 P40926 2/20 0.38
PGR P06401 2/20 0.34
GAA P10253 1/20 0.33
NCOA3 Q9Y6Q9 1/20 0.33
HSD11B1 P28845 1/20 0.33
CASP2 P42575 1/20 0.33
HTT P42858 2/20 0.32
RAD52 P43351 2/20 0.32
EPAS1 Q99814 1/20 0.32
SMN1; SMN2 Q16637 2/20 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
SCHEMBL3843528 0.83 MEN1 (0.40) MEN1KMT2ALMNAALDH1A1L3MBTL1
SCHEMBL3845028 0.82 ESR1 (0.52) MEN1KMT2ALMNAALDH1A1L3MBTL1
SCHEMBL3848134 0.82 ESR1 (0.39) MEN1KMT2ALMNAALDH1A1L3MBTL1
SCHEMBL3841503 0.81 MDH2 (0.31) HIF1AMDH2
SCHEMBL3842591 0.79 ESR1 (0.46) MEN1KMT2ALMNAALDH1A1L3MBTL1
SCHEMBL3844877 0.79 MEN1 (0.40) MEN1KMT2ALMNAALDH1A1L3MBTL1
SCHEMBL3841910 0.78 ESR1 (0.43) MEN1KMT2ALMNAALDH1A1ESR1
SCHEMBL3842296 0.76 ESR1 (0.46) MEN1KMT2ALMNAALDH1A1L3MBTL1
SCHEMBL3853806 0.75 ESR1 (0.46) MEN1KMT2ALMNAALDH1A1L3MBTL1
SCHEMBL3843224 0.75 PGR (0.33) ALDH1A1PGR

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