SCHEMBL8772722

SCHEMBL8772722

CCCCCCCCCOc1cc(CCCO)cc(OC)c1OC

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TNKS2 Q9H2K2 1/20 0.51
TUBB1 Q9H4B7 2/20 0.47
TUBB4A P04350 1/20 0.47
TUBB P07437 1/20 0.47
TUBA3C P0DPH7 1/20 0.47
TUBA1B P68363 1/20 0.47
TUBA4A P68366 1/20 0.47
TUBB4B P68371 1/20 0.47
TUBB3 Q13509 1/20 0.47
TUBB2A Q13885 1/20 0.47
TUBB8 Q3ZCM7 1/20 0.47
TUBA3E Q6PEY2 1/20 0.47
TUBA1A Q71U36 1/20 0.47
TUBA1C Q9BQE3 1/20 0.47
TUBB6 Q9BUF5 1/20 0.47
TUBB2B Q9BVA1 1/20 0.47
ALOX5 P09917 3/20 0.46
HTR2A P28223 1/20 0.45
HTR2C P28335 1/20 0.45
HTR2B P41595 1/20 0.45

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
SCHEMBL8772645 0.91 TNKS2 (0.54) TNKS2HTR2AHTR2CHTR2BPPARG
SCHEMBL27570422 0.87 TNKS2 (0.53) TNKS2TUBB1TUBB4ATUBBTUBA3C
SCHEMBL2007007 0.84 TNKS2 (0.68) TNKS2TUBB1TUBB4ATUBBTUBA3C
SCHEMBL8772665 0.84 HTR2A (0.46) TUBB1TUBB4ATUBBTUBA3CTUBA1B
SCHEMBL10774727 0.83 PTGS2 (0.59) TUBB1TUBB4ATUBBTUBA3CTUBA1B
SCHEMBL10772012 0.83 PTGS2 (0.59) TUBB1TUBB4ATUBBTUBA3CTUBA1B
SCHEMBL10773005 0.83 PTGS2 (0.59) TUBB1TUBB4ATUBBTUBA3CTUBA1B
SCHEMBL19194199 0.82 TNKS2 (0.47) TNKS2HTR2AHTR2CHTR2BPTGS2
SCHEMBL4740186 0.81 TUBB4A (0.61) TNKS2TUBB1TUBB4ATUBBTUBA3C
SCHEMBL5514786 0.81 PTGS2 (0.61) TUBB1TUBB4ATUBBTUBA3CTUBA1B

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-0801071-A1 LEWIS X DERIVATIVE AND PROCESS FOR PRODUCING THE SAME SUMITOMO PHARMACEUTICALS COMPANY, LIMITED (JP) 1997-10-15 EP disclosed