SCHEMBL8930356

SCHEMBL8930356

COc1ccc(OC(C)=O)cc1S(=O)(=O)O

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.51
TUBB4A P04350 2/20 0.49
TUBB P07437 2/20 0.49
TUBA3C P0DPH7 2/20 0.49
TUBA1B P68363 2/20 0.49
TUBA4A P68366 2/20 0.49
TUBB4B P68371 2/20 0.49
TUBB3 Q13509 2/20 0.49
TUBB2A Q13885 2/20 0.49
TUBB8 Q3ZCM7 2/20 0.49
TUBA3E Q6PEY2 2/20 0.49
TUBA1A Q71U36 2/20 0.49
TUBA1C Q9BQE3 2/20 0.49
TUBB6 Q9BUF5 2/20 0.49
TUBB2B Q9BVA1 2/20 0.49
TUBB1 Q9H4B7 2/20 0.49
L3MBTL1 Q9Y468 1/20 0.47
MAPT P10636 3/20 0.47
POLB P06746 1/20 0.46
PKM P14618 1/20 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
SCHEMBL29556983 0.90 KMT2A (0.61) KMT2ATUBB4ATUBBTUBA3CTUBA1B
SCHEMBL343567 0.90 KMT2A (0.61) KMT2ATUBB4ATUBBTUBA3CTUBA1B
SCHEMBL342726 0.89 KMT2A (0.59) KMT2ATUBB4ATUBBTUBA3CTUBA1B
SCHEMBL668653 0.84 L3MBTL1 (0.64) KMT2AL3MBTL1MAPTLMNAALDH1A1
SCHEMBL30965843 0.84 L3MBTL1 (0.64) KMT2AL3MBTL1MAPTLMNAALDH1A1
Hydrochloric Acid SCHEMBL27876200 0.83 L3MBTL1 (0.62) KMT2AL3MBTL1MAPTLMNAALDH1A1
SCHEMBL8930357 0.81 TUBB4A (0.52) KMT2ATUBB4ATUBBTUBA3CTUBA1B
SCHEMBL343614 0.80 CYP3A4 (0.51) KMT2AMAPTPOLBPKMLMNA
SCHEMBL17419284 0.80 KDM4E (0.56) KMT2ATUBB4ATUBBTUBA3CTUBA1B
SCHEMBL153056 0.79 CA12 (0.59) KMT2ATUBB4ATUBBTUBA3CTUBA1B

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-5665150-A Dye and ink compositions XEROX CORPORATION (US) 1997-09-09 US disclosed