SCHEMBL9958039

SCHEMBL9958039

COc1ccc(OC(C)=O)cc1OS(C)(=O)=O

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
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
KDM4E B2RXH2 1/20 0.49
MAPT P10636 2/20 0.46
POLB P06746 1/20 0.46
PKM P14618 1/20 0.46
ALDH1A1 P00352 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
SCHEMBL9957379 0.95 TUBB4A (0.48) TUBB4ATUBBTUBA3CTUBA1BTUBA4A
SCHEMBL9958314 0.89 TNFSF11 (0.47) TUBB4ATUBBTUBA3CTUBA1BTUBA4A
SCHEMBL153056 0.86 CA12 (0.59) TUBB4ATUBBTUBA3CTUBA1BTUBA4A
SCHEMBL9958587 0.86 TSHR (0.54) TUBB4ATUBBTUBA3CTUBA1BTUBA4A
SCHEMBL9957646 0.86 BACE1 (0.50) TUBB4ATUBBTUBA3CTUBA1BTUBA4A
SCHEMBL9958007 0.86 CA12 (0.43) MAPTALDH1A1GAAKMT2AMEN1
SCHEMBL9957685 0.83 CA12 (0.54) KDM4EMAPTPOLBALDH1A1GAA
SCHEMBL6935981 0.83 CA12 (0.65) MAPTPOLBALDH1A1KMT2AMEN1
SCHEMBL27657706 0.83 MAPT (0.45) TUBB4ATUBBTUBA3CTUBA1BTUBA4A
SCHEMBL9957664 0.81 CA12 (0.42) MAPTALDH1A1GAAKMT2AMEN1

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9029024-B2 Nonaqueous electrolyte solution and electrochemical element using same UBE INDUSTRIES, LTD. (JP) 2015-05-12 US disclosed
EP-2469638-B1 NON-AQUEOUS ELECTROLYTIC SOLUTION AND ELECTROCHEMICAL DEVICE USING THE SAME UBE INDUSTRIES (JP) 2014-10-01 EP disclosed
US-20120189919-A1 NONAQUEOUS ELECTROLYTE SOLUTION AND ELECTROCHEMICAL ELEMENT USING SAME UBE INDUSTRIES, LTD. (JP) 2012-07-26 US disclosed
EP-2469638-A1 NONAQUEOUS ELECTROLYTE SOLUTION AND ELECTROCHEMICAL ELEMENT USING SAME Ube Industries, Ltd. (JP) 2012-06-27 EP disclosed