SCHEMBL3846397

SCHEMBL3846397

CC=Cc1cc(C=CC)cc(C23CC4(c5cc(C=CC)cc(C=CC)c5)CC(c5cc(C=CC)cc(C=CC)c5)(C2)CC(C25CC6(c7cc(C=CC)cc(C=CC)c7)CC(c7cc(C=CC)cc(C=CC)c7)(CC(c7cc(C=CC)cc(C=CC)c7)(C6)C2)C5)(C3)C4)c1

nearest known ligand 0.39

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 2/20 0.39
ATM Q13315 1/20 0.39
CNR2 P34972 1/20 0.34
LMNA P02545 1/20 0.32
TP53 P04637 1/20 0.32
TSHR P16473 1/20 0.32
KDM4E B2RXH2 1/20 0.32
ALDH1A1 P00352 1/20 0.32
PDK2 Q15119 1/20 0.31
TYR P14679 1/20 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
SCHEMBL3846394 1.00 CYP3A4 (0.39) CYP3A4ATMCNR2LMNATP53
SCHEMBL3846003 0.90 CYP3A4 (0.37) CYP3A4ATMCNR2LMNATP53
SCHEMBL3845999 0.90 CYP3A4 (0.37) CYP3A4ATMCNR2LMNATP53
SCHEMBL3846361 0.88 CYP3A4 (0.34) CYP3A4ATMCNR2
SCHEMBL3846365 0.88 CYP3A4 (0.34) CYP3A4ATMCNR2
SCHEMBL3845580 0.87 CYP3A4 (0.32) CYP3A4ATM
SCHEMBL3845578 0.87 CYP3A4 (0.32) CYP3A4ATM
SCHEMBL3846621 0.84 GRIN2D (0.35) CYP3A4ATMLMNAKDM4EALDH1A1
SCHEMBL3846620 0.84 GRIN2D (0.35) CYP3A4ATMLMNAKDM4EALDH1A1
SCHEMBL3847001 0.83 CYP3A4 (0.33) CYP3A4ATM

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