SCHEMBL3842360

SCHEMBL3842360

C#CCOc1ccc(C23CC4CC(c5ccc(OCC#C)cc5OCC#C)(C2)CC(C25CC6CC(CC(C6)C2)C5)(C4)C3)c(OCC#C)c1

nearest known ligand 0.33

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MDH2 P40926 1/20 0.33
HIF1A Q16665 1/20 0.33
MEN1 O00255 2/20 0.32
KMT2A Q03164 2/20 0.32
ALDH1A1 P00352 1/20 0.32
LMNA P02545 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
GSTP1 P09211 1/20 0.32
CA12 O43570 3/20 0.31
CA4 P22748 3/20 0.31
CA9 Q16790 3/20 0.31
CA1 P00915 1/20 0.31
RAB9A P51151 1/20 0.30

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
SCHEMBL3846137 0.95 GSTP1 (0.34) ALDH1A1GSTP1CA12CA4CA9
SCHEMBL3849937 0.94 KMT2A (0.32) MDH2HIF1AKMT2AGSTP1CA12
SCHEMBL3850515 0.93 GSTP1 (0.33) ALDH1A1GSTP1CA12CA4CA9
SCHEMBL3849520 0.90 KMT2A (0.34) MDH2HIF1AMEN1KMT2AALDH1A1
SCHEMBL3841823 0.89 KMT2A (0.32) MDH2HIF1AKMT2AGSTP1CA12
SCHEMBL3842290 0.83 GSTP1 (0.39) ALDH1A1GSTP1CA12CA4CA9
SCHEMBL3850493 0.82 MEN1 (0.46) MDH2HIF1AMEN1KMT2AALDH1A1
SCHEMBL3841792 0.81 MAOB (0.33) ALDH1A1GSTP1CA12CA4CA9
SCHEMBL3841200 0.80 ADRA2A (0.36) MEN1KMT2AALDH1A1LMNAL3MBTL1
SCHEMBL3841503 0.77 MDH2 (0.31) MDH2HIF1A

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