SCHEMBL27918743

SCHEMBL27918743

COc1ccc([Se](=O)c2ccc(OC)cc2-c2cc(OC)c(OC)c(OC)c2)c(-c2cc(OC)c(OC)c(OC)c2)c1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ FYN P06241 2/20 0.46
▸ TUBB4A P04350 6/20 0.44
▸ TUBB P07437 6/20 0.44
▸ TUBA3C P0DPH7 6/20 0.44
▸ TUBA1B P68363 6/20 0.44
▸ TUBA4A P68366 6/20 0.44
▸ TUBB4B P68371 6/20 0.44
▸ TUBB3 Q13509 6/20 0.44
▸ TUBB2A Q13885 6/20 0.44
▸ TUBB8 Q3ZCM7 6/20 0.44
▸ TUBA3E Q6PEY2 6/20 0.44
▸ TUBA1A Q71U36 6/20 0.44
▸ TUBA1C Q9BQE3 6/20 0.44
▸ TUBB6 Q9BUF5 6/20 0.44
▸ TUBB2B Q9BVA1 6/20 0.44
▸ TUBB1 Q9H4B7 6/20 0.44
▸ KDR P35968 1/20 0.42
▸ GSK3B P49841 1/20 0.42
▸ CYP1A1 P04798 1/20 0.42
▸ CYP1A2 P05177 1/20 0.42

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
SCHEMBL27901006 0.82 ALDH1A1 (0.45) FYNTUBB4ATUBBTUBA3CTUBA1B
SCHEMBL27918739 0.77 FYN (0.48) FYNTUBB4ATUBBTUBA3CTUBA1B
SCHEMBL27918738 0.75 FYN (0.47) FYNTUBB4ATUBBTUBA3CTUBA1B
SCHEMBL6504013 0.74 TUBB4A (0.44) FYNTUBB4ATUBBTUBA3CTUBA1B
SCHEMBL13952628 0.73 TUBB4A (0.55) FYNTUBB4ATUBBTUBA3CTUBA1B
SCHEMBL17320121 0.73 ERN1 (0.59) FYNTUBB4ATUBBTUBA3CTUBA1B
SCHEMBL17304629 0.72 APP (0.51) TUBB4ATUBBTUBA3CTUBA1BTUBA4A
SCHEMBL14097284 0.71 FYN (0.59) FYNTUBB4ATUBBTUBA3CTUBA1B
SCHEMBL27918740 0.69 TUBB1 (0.53) TUBB4ATUBBTUBA3CTUBA1BTUBA4A
SCHEMBL24860583 0.69 EPHB4 (0.54) FYNTUBB4ATUBBTUBA3CTUBA1B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-103086935-B Diphenyl selenide, diphenyl selenoxide, diphenyl selenone compounds and uses thereof UNIV SHENYANG PHARMACEUTICAL 2015-05-20 — — CN claimed
CN-103086935-B Diphenyl selenide, diphenyl selenoxide, diphenyl selenone compounds and uses thereof UNIV SHENYANG PHARMACEUTICAL 2015-05-20 — — CN disclosed
CN-103086935-A Diphenyl selenide, diphenyl selenoxide, diphenyl selenone compounds and uses thereof UNIV SHENYANG PHARMACEUTICAL 2013-05-08 — — CN disclosed
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