SCHEMBL5855658

SCHEMBL5855658

O=S(=O)(ON(OS(=O)(=O)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F)c1cccc2ccccc12)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA1 P00915 13/20 0.35
CA2 P00918 13/20 0.35
TUBB4A P04350 1/20 0.34
TUBB P07437 1/20 0.34
TUBA3C P0DPH7 1/20 0.34
STAT3 P40763 1/20 0.34
TUBA1B P68363 1/20 0.34
TUBA4A P68366 1/20 0.34
TUBB4B P68371 1/20 0.34
TUBB3 Q13509 1/20 0.34
TUBB2A Q13885 1/20 0.34
TUBB8 Q3ZCM7 1/20 0.34
TUBA3E Q6PEY2 1/20 0.34
TUBA1A Q71U36 1/20 0.34
TUBA1C Q9BQE3 1/20 0.34
TUBB6 Q9BUF5 1/20 0.34
TUBB2B Q9BVA1 1/20 0.34
TUBB1 Q9H4B7 1/20 0.34
SIGMAR1 Q99720 1/20 0.33
KDM4E B2RXH2 1/20 0.32

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
SCHEMBL718079 0.84 KDM4E (0.38) CA1CA2TUBB4ATUBBTUBA3C
SCHEMBL5857018 0.76 CA1 (0.39) CA1CA2NR1H2MMP1MMP2
SCHEMBL15239044 0.76 MMP1 (0.41) CA1CA2SIGMAR1KDM4ERORA
SCHEMBL31299571 0.75 CA1 (0.39) CA1CA2KDM4ECA9MEN1
SCHEMBL2898214 0.75 CA1 (0.35) CA1CA2RORARORCNR1H2
SCHEMBL2903531 0.74 CA2 (0.36) CA1CA2RORARORCNR1H2
SCHEMBL3114242 0.71 CA1 (0.41) CA1CA2KDM4ERORARORC
SCHEMBL3114547 0.70 CA1 (0.40) CA1CA2KDM4ERORARORC
SCHEMBL3107027 0.69 CA1 (0.39) CA1CA2KDM4ERORARORC
SCHEMBL3680642 0.69 RORA (0.40) CA1CA2RORARORCNR1H2

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
US-7022466-B2 Pattern formation method MATSUSHITA ELECTRIC INDUSTRIAL CO., LTD. (JP) 2006-04-04 US claimed
US-7022466-B2 Pattern formation method MATSUSHITA ELECTRIC INDUSTRIAL CO., LTD. (JP) 2006-04-04 US disclosed
US-20030143494-A1 Pattern formation method MATSUSHITA ELECTRIC INDUSTRIAL CO., LITD. (JP) 2003-07-31 US disclosed