SCHEMBL3843439

SCHEMBL3843439

C#Cc1[c]cc(-c2ccccc2)c(-c2ccccc2)c1-c1ccccc1

nearest known ligand 0.36

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
CYP2A6 P11509 1/20 0.33
LMNA P02545 1/20 0.31
MAPT P10636 1/20 0.31
HTT P42858 1/20 0.31
BACE1 P56817 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
SCHEMBL3850051 0.78 CYP2A6 (0.33) CYP2A6LMNAMAPTHTTBACE1
SCHEMBL3845811 0.75 CYP19A1 (0.34) CYP2A6
SCHEMBL3843630 0.74 BACE1 (0.34) CYP2A6LMNAMAPTHTTBACE1
SCHEMBL770088 0.72 LMNA (0.36) CYP2A6LMNAMAPTHTTBACE1
SCHEMBL3840723 0.71 CYP19A1 (0.34) CYP2A6
SCHEMBL12816030 0.71 CYP2A6 (0.36) CYP2A6LMNAMAPTHTTBACE1
SCHEMBL2423292 0.69 CYP2A6 (0.40) CYP2A6BACE1
SCHEMBL27693322 0.67 CYP2A6 (0.37) CYP2A6LMNAMAPTHTTBACE1
SCHEMBL9718190 0.67 GCGR (0.34) LMNAMAPTHTTBACE1
SCHEMBL22129263 0.67 PTGS1 (0.35) LMNAMAPTHTTBACE1

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