SCHEMBL9859825

SCHEMBL9859825

C=C(C(=O)C(=C)c1cc(OC)c(OC)c(OC)c1)c1cc(OC)c(OC)c(OC)c1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TUBB4A P04350 4/20 0.51
▸ TUBB P07437 4/20 0.51
▸ TUBA3C P0DPH7 4/20 0.51
▸ TUBA1B P68363 4/20 0.51
▸ TUBA4A P68366 4/20 0.51
▸ TUBB4B P68371 4/20 0.51
▸ TUBB3 Q13509 4/20 0.51
▸ TUBB2A Q13885 4/20 0.51
▸ TUBB8 Q3ZCM7 4/20 0.51
▸ TUBA3E Q6PEY2 4/20 0.51
▸ TUBA1A Q71U36 4/20 0.51
▸ TUBA1C Q9BQE3 4/20 0.51
▸ TUBB6 Q9BUF5 4/20 0.51
▸ TUBB2B Q9BVA1 4/20 0.51
▸ TUBB1 Q9H4B7 4/20 0.51
▸ TPMT P51580 1/20 0.50
▸ KMT2A Q03164 4/20 0.49
▸ MEN1 O00255 3/20 0.49
▸ ABCG2 Q9UNQ0 1/20 0.49
▸ MAPT P10636 2/20 0.48

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
SCHEMBL7639319 0.86 TPMT (0.53) TUBB4ATUBBTUBA3CTUBA1BTUBA4A
SCHEMBL4035371 0.85 HTT (0.53) TUBB4ATUBBTUBA3CTUBA1BTUBA4A
SCHEMBL29002168 0.85 MEN1 (0.50) TUBB4ATUBBTUBA3CTUBA1BTUBA4A
SCHEMBL28779745 0.85 TUBB4A (0.49) TUBB4ATUBBTUBA3CTUBA1BTUBA4A
SCHEMBL3022881 0.79 TUBB1 (0.55) TUBB4ATUBBTUBA3CTUBA1BTUBA4A
SCHEMBL28901970 0.79 KMT2A (0.59) TUBB4ATUBBTUBA3CTUBA1BTUBA4A
SCHEMBL4819729 0.79 TUBB4A (0.75) TUBB4ATUBBTUBA3CTUBA1BTUBA4A
SCHEMBL4625442 0.79 TUBB1 (0.58) TUBB4ATUBBTUBA3CTUBA1BTUBA4A
SCHEMBL20006949 0.78 TUBB1 (0.56) TUBB4ATUBBTUBA3CTUBA1BTUBA4A
SCHEMBL7960025 0.78 MEN1 (0.59) TUBB4ATUBBTUBA3CTUBA1BTUBA4A

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-5010100-A Skeletal muscular disorders, hydertensive agents, cardiovascular disorders MERCK & CO. INC. (US) 1991-04-23 — — US disclosed
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