SCHEMBL2124063

SCHEMBL2124063

COc1ccc(C2Oc3c(c(O)cc(OC)c3OC)CC2=O)cc1O

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TUBB4A P04350 5/20 0.47
TUBB P07437 5/20 0.47
TUBA3C P0DPH7 5/20 0.47
TUBA1B P68363 5/20 0.47
TUBA4A P68366 5/20 0.47
TUBB4B P68371 5/20 0.47
TUBB3 Q13509 5/20 0.47
TUBB2A Q13885 5/20 0.47
TUBB8 Q3ZCM7 5/20 0.47
TUBA3E Q6PEY2 5/20 0.47
TUBA1A Q71U36 5/20 0.47
TUBA1C Q9BQE3 5/20 0.47
TUBB6 Q9BUF5 5/20 0.47
TUBB2B Q9BVA1 5/20 0.47
TUBB1 Q9H4B7 5/20 0.47
CYP19A1 P11511 3/20 0.42
XDH P47989 3/20 0.42
TP53 P04637 2/20 0.42
CYP3A4 P08684 2/20 0.42
GSK3B P49841 2/20 0.42

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
SCHEMBL28840935 0.87 CYP19A1 (0.46) TUBB4ATUBBTUBA3CTUBA1BTUBA4A
SCHEMBL382209 0.84 TUBB4A (0.47) TUBB4ATUBBTUBA3CTUBA1BTUBA4A
SCHEMBL29270987 0.82 CDK1 (0.44) XDHCYP3A4GSK3BMAPTMAPK1
SCHEMBL2319151 0.81 CYP19A1 (0.57) CYP19A1XDHTP53CYP3A4GSK3B
SCHEMBL14829729 0.80 CYP19A1 (0.52) CYP19A1XDHTP53CYP3A4GSK3B
SCHEMBL27950799 0.80 TAS2R31 (0.39) CYP19A1MAPTNPC1ALDH1A1RAB9A
SCHEMBL4129050 0.79 CDK1 (0.47) TUBB4ATUBBTUBA3CTUBA1BTUBA4A
SCHEMBL28085134 0.78 CDK1 (0.45) XDHGSK3BMAPK1RAB9APDE4D
SCHEMBL27205452 0.78 CYP19A1 (0.45) TUBB4ATUBBTUBA3CTUBA1BTUBA4A
SCHEMBL18339272 0.78 CYP19A1 (0.45) 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 8 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9345660-B2 Micro-emulsions for the treatment of rheumatic disorders SUNEV PHARMA SOLUTION LIMITED (IN) 2016-05-24 US disclosed
US-20120093888-A1 MICRO-EMULSIONS FOR THE TREATMENT OF RHEUMATIC DISORDERS SUNEV PHARMA SOLUTION LIMITED (IN) 2012-04-19 US disclosed
EP-2437725-A1 TOPICAL MICRO-EMULSIONS FOR THE TREATMENT OF RHEUMATIC DISORDERS Sunev Pharma Solution Limited (IN) 2012-04-11 EP disclosed
WO-2010140170-A1 TOPICAL MICRO-EMULSIONS FOR THE TREATMENT OF RHEUMATIC DISORDERS SUNEV PHARMA SOLUTION LIMITED (IN) 2010-12-09 WO disclosed
EP-1509223-B1 HEPATOPROTECTIVE ACTIVITY OF 10-O-P-HYDROXYBENZOYIAUCUBIN COUNCIL SCIENT IND RES (IN) 2008-08-20 EP disclosed
EP-1509223-A1 HEPATOPROTECTIVE ACTIVITY OF 10-O-P-HYDROXYBENZOYIAUCUBIN Council Of Scientific And Industrial Research (IN) 2005-03-02 EP disclosed
US-20040029816-A1 Hepatoprotective activity of 10-O-P-hydroxybenzoyiaucubin COUNCIL OF SCIENTIFIC AND INDUSTRIAL RESEARCH 2004-02-12 US disclosed
WO-2003094911-A1 HEPATOPROTECTIVE ACTIVITY OF 10-O-P-HYDROXYBENZOYIAUCUBIN COUNCIL OF SCIENTIFIC AND INDUSTRIAL RESEARCH (IN) 2003-11-20 WO disclosed