SCHEMBL3845893

SCHEMBL3845893

Oc1ccc(C23CC4CC(C2)CC(C25CC6(c7ccc(O)cc7O)CC(c7ccc(O)cc7O)(CC(c7ccc(O)cc7O)(C6)C2)C5)(C4)C3)c(O)c1

nearest known ligand 0.67

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 1/20 0.38
KMT2A Q03164 4/20 0.37
MEN1 O00255 3/20 0.37
POLB P06746 1/20 0.37
GAA P10253 1/20 0.37
GFER P55789 1/20 0.37
THRB P10828 1/20 0.34
RECQL P46063 1/20 0.34
NR2E1 Q9Y466 1/20 0.34
ESR1 P03372 1/20 0.34
HSP90AA1 P07900 1/20 0.34
RARB P10826 2/20 0.33
RARA P10276 1/20 0.33
RARG P13631 1/20 0.33
ALOX5AP P20292 1/20 0.33
PGR P06401 1/20 0.32
TDP1 Q9NUW8 1/20 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
SCHEMBL3845041 0.95 KMT2A (0.40) CNR2KMT2AMEN1POLBGAA
SCHEMBL3849641 0.93 CNR2 (0.37) CNR2KMT2AMEN1POLBGAA
SCHEMBL2426368 0.91 KMT2A (0.43) CNR2KMT2AMEN1POLBGAA
SCHEMBL3842486 0.88 CNR2 (0.34) CNR2KMT2AMEN1POLBGAA
SCHEMBL3846906 0.85 MEN1 (0.41) CNR2KMT2AMEN1POLBGAA
SCHEMBL3843069 0.84 CNR2 (0.35) CNR2KMT2AMEN1POLBGAA
SCHEMBL3844976 0.84 TYR (0.35) ESR1
SCHEMBL14040564 0.82 CNR2 (0.43) CNR2KMT2AMEN1POLBGAA
SCHEMBL2420330 0.81 MEN1 (0.50) CNR2KMT2AMEN1POLBGAA
SCHEMBL3759906 0.81 CNR2 (0.38) CNR2KMT2AMEN1POLBGAA

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