SCHEMBL6976023

SCHEMBL6976023

COc1ccc(-c2sc3cc(OC)ccc3c2-c2cc(OC)ccc2C(=O)c2ccc(OC)cc2-c2c(-c3ccc(OC)cc3)sc3cc(OC)ccc23)cc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TUBB4A P04350 3/20 0.56
TUBB P07437 3/20 0.56
TUBA3C P0DPH7 3/20 0.56
TUBA1B P68363 3/20 0.56
TUBA4A P68366 3/20 0.56
TUBB4B P68371 3/20 0.56
TUBB3 Q13509 3/20 0.56
TUBB2A Q13885 3/20 0.56
TUBB8 Q3ZCM7 3/20 0.56
TUBA3E Q6PEY2 3/20 0.56
TUBA1A Q71U36 3/20 0.56
TUBA1C Q9BQE3 3/20 0.56
TUBB6 Q9BUF5 3/20 0.56
TUBB2B Q9BVA1 3/20 0.56
TUBB1 Q9H4B7 3/20 0.56
L3MBTL1 Q9Y468 5/20 0.49
TDP1 Q9NUW8 3/20 0.49
CNR1 P21554 2/20 0.49
CNR2 P34972 2/20 0.49
ESR1 P03372 4/20 0.46

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
SCHEMBL5409936 0.80 TUBB4A (0.47) TUBB4ATUBBTUBA3CTUBA1BTUBA4A
SCHEMBL8640626 0.79 HSP90AA1 (0.50) TUBB4ATUBBTUBA3CTUBA1BTUBA4A
SCHEMBL10170739 0.78 HSP90AA1 (0.57) TUBB4ATUBBTUBA3CTUBA1BTUBA4A
SCHEMBL5026252 0.78 CNR1 (0.78) TUBB4ATUBBTUBA3CTUBA1BTUBA4A
SCHEMBL7104456 0.76 TUBB4A (0.46) TUBB4ATUBBTUBA3CTUBA1BTUBA4A
SCHEMBL5027082 0.75 TUBB4A (0.77) TUBB4ATUBBTUBA3CTUBA1BTUBA4A
SCHEMBL7077281 0.75 TUBB4A (0.69) TUBB4ATUBBTUBA3CTUBA1BTUBA4A
SCHEMBL7104458 0.74 CNR2 (0.76) TUBB4ATUBBTUBA3CTUBA1BTUBA4A
SCHEMBL8158106 0.74 TUBB4A (0.72) TUBB4ATUBBTUBA3CTUBA1BTUBA4A
Hydrochloric Acid SCHEMBL7748537 0.74 TUBB4A (0.67) 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
EP-0832888-B1 Benzothiophene compounds, compositions, and methods LILLY CO ELI (US) 2003-07-23 EP disclosed