SCHEMBL6533122

SCHEMBL6533122

C1=Cc2c(C=Cc3ccccc3)cccc2C1

nearest known ligand 0.47

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
NFE2L2 Q16236 10/20 0.47
TRPA1 O75762 2/20 0.43
CHAT P28329 3/20 0.36
DHFR P00374 1/20 0.36
MAOB P27338 2/20 0.35
CYP19A1 P11511 1/20 0.35
MAOA P21397 1/20 0.35

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
SCHEMBL22669111 0.76
(Z)-1,2-Diphenylethene SCHEMBL27493505 0.74 CA1 (0.44) NFE2L2TRPA1CHATMAOBCYP19A1
SCHEMBL7636146 0.74 ALDH1A1 (0.34)
SCHEMBL29561529 0.74 MEN1 (0.41)
SCHEMBL28757237 0.74 CA1 (0.30)
SCHEMBL23854833 0.74 CA1 (0.30)
SCHEMBL27739762 0.73 MEN1 (0.39)
(Z)-1,2-Diphenylethene SCHEMBL11498205 0.70 RELA (0.37) NFE2L2MAOBCYP19A1MAOA
SCHEMBL44503 0.70 NFE2L2 (0.68) NFE2L2TRPA1CHATMAOBCYP19A1
SCHEMBL6360540 0.70 NFE2L2 (0.68) NFE2L2TRPA1CHATMAOBCYP19A1

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050042548-A1 Self-aligned contact doping for organic field-effect transistors and method for fabricating the transistor KLAUK HAGEN (DE) 2005-02-24 US disclosed